0 B9R1.6 C1(CC=CCC1)C(=O)O MCULE-7139174666 [0,0,0,0,0,0|1,0,1]=2 1 B9R1.6 C1(CCCNC1)C(=O)N MCULE-1974021716 [0,0,0,0,0,0|1,0,0]=1 2 B9R1.6 C1(CCCNC1)C(=O)N MCULE-3484822743 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.6 C1(CCCNC1)C(=O)O MCULE-5804171064 [0,0,0,0,0,0|0,0,0]=0 4 B9R1.6 C1(CNCCN1)C(=O)O MCULE-2145678876 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.6 C1(CNCCN1)C(=O)O MCULE-9477513225 [0,0,0,0,0,0|1,0,0]=1 6 B9R1.6 C1(COCCN1)C(=O)O MCULE-7653061162 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 C1(COCCN1)C(=O)O MCULE-8375563970 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 C=C(O)C1CNCCN1 MCULE-4032832858 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 C=C(O)C1CNCCN1 MCULE-7014741917 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 CC(=O)C1=CCCCC1 MCULE-9958324589 [0,0,0,0,0,0|2,0,2]=4 11 B9R1.6 CC(=O)C1=NCCCC1 MCULE-8103583007 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 CC(=O)C1=NCCCC1 MCULE-8275418154 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 CC(=O)C1CCCCC1 MCULE-3582349091 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(=O)C1CCCCN1 MCULE-2854776557 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.6 CC(=O)C1CCCCN1 MCULE-7483298696 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.6 CC(=O)C1CCCCO1 MCULE-6292051941 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.6 CC(=O)C1CCCNC1 MCULE-5048287619 [0,0,0,0,0,0|1,0,0]=1 18 B9R1.6 CC(=O)C1CCCNC1 MCULE-7308448482 [0,0,0,0,0,0|1,0,0]=1 19 B9R1.6 CC(=O)C1CCCOC1 MCULE-8355092375 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 CC(=O)C1CCNCC1 MCULE-5629644359 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.6 CC(=O)C1CCNCC1 MCULE-7994490746 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.6 CC(=O)C1CCOCC1 MCULE-4829713073 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.6 CC(=O)C1CCSCC1 MCULE-1825777359 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.6 CC(=O)C1CNCCO1 MCULE-1332213026 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.6 CC(=O)C1CNCCO1 MCULE-8599628301 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.6 CC(=O)C1COCCO1 MCULE-5168266299 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.6 CC(=O)N1CCCCC1 MCULE-2376049669 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.6 CC(=O)N1CCCNC1 MCULE-1504945403 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.6 CC(=O)N1CCNCC1 MCULE-6090938298 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.6 CC(=O)N1CCNCC1 MCULE-6273641444 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.6 CC(=O)N1CCOCC1 MCULE-8135519320 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-6225629414 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-9308955565 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6405789728 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6966774576 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.6 CC(Br)C1CCCCC1 MCULE-5485461450 [0,0,0,0,0,0|3,0,1]=4 37 B9R1.6 CC(C)C1CCCCC1 MCULE-6669359076 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.6 CC(C)C1CCCNC1 MCULE-3359180558 [0,0,0,0,0,0|2,0,1]=3 39 B9R1.6 CC(C)C1CCCNC1 MCULE-3374264203 [0,0,0,0,0,0|2,0,1]=3 40 B9R1.6 CC(C)C1CNCCN1 MCULE-3322885817 [0,0,0,0,0,0|3,0,1]=4 41 B9R1.6 CC(C)C1CNCCN1 MCULE-9013186060 [0,0,0,0,0,0|3,0,1]=4 42 B9R1.6 CC(C)C1CNCCO1 MCULE-1548709816 [0,0,0,0,0,0|3,0,1]=4 43 B9R1.6 CC(C)C1CNCCO1 MCULE-3698866028 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.6 CC(C)C1CNCCS1 MCULE-3005004947 [0,0,0,0,0,0|3,0,1]=4 45 B9R1.6 CC(C)[C@@H]1CNCCN1 MCULE-6388876038 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.6 CC(C)[C@@H]1CNCCN1 MCULE-7346562027 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.6 CC(C)[C@@H]1CNCCO1 MCULE-4730564774 [0,0,0,0,0,0|3,0,1]=4 48 B9R1.6 CC(C)[C@@H]1CNCCO1 MCULE-6895424671 [0,0,0,0,0,0|3,0,1]=4 49 B9R1.6 CC(C)[C@H]1CNCCN1 MCULE-1366611041 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.6 CC(C)[C@H]1CNCCN1 MCULE-4324346878 [0,0,0,0,0,0|3,0,1]=4 51 B9R1.6 CC(C)[C@H]1CNCCN1 MCULE-5182197423 [0,0,0,0,0,0|3,0,1]=4 52 B9R1.6 CC(C)[C@H]1CNCCN1 MCULE-9806457196 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.6 CC(C)[C@H]1CNCCO1 MCULE-6888809992 [0,0,0,0,0,0|3,0,1]=4 54 B9R1.6 CC(C)[C@H]1CNCCO1 MCULE-8313613560 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.6 CC(N)C1CCCCC1 MCULE-1505914332 [0,0,0,0,0,0|3,0,1]=4 56 B9R1.6 CC(N)C1CCCCC1 MCULE-2391650892 [0,0,0,0,0,0|3,0,1]=4 57 B9R1.6 CC(N)C1CCCCC1 MCULE-4413711215 [0,0,0,0,0,0|3,0,1]=4 58 B9R1.6 CC(N)C1CCCNC1 MCULE-8605982838 [0,0,0,0,0,0|2,0,1]=3 59 B9R1.6 CC(O)C1CCCCC1 MCULE-5078012753 [0,0,0,0,0,0|2,0,1]=3 60 B9R1.6 CC(O)C1CCCCN1 MCULE-2559324365 [0,0,0,0,0,0|3,0,1]=4 61 B9R1.6 CC(O)C1CCCNC1 MCULE-2671166499 [0,0,0,0,0,0|1,0,1]=2 62 B9R1.6 CC(O)C1CCCNC1 MCULE-3528761801 [0,0,0,0,0,0|1,0,1]=2 63 B9R1.6 CC(O)C1CCNCC1 MCULE-4584203332 [0,0,0,0,0,0|3,0,1]=4 64 B9R1.6 CC(O)C1CCNCC1 MCULE-5499145407 [0,0,0,0,0,0|3,0,1]=4 65 B9R1.6 CC(O)C1CCNCC1 MCULE-6172957789 [0,0,0,0,0,0|3,0,1]=4 66 B9R1.6 CC(O)C1CCNCC1 MCULE-9287143291 [0,0,0,0,0,0|3,0,1]=4 67 B9R1.6 CC(O)C1CCOCC1 MCULE-9618372743 [0,0,0,0,0,0|3,0,1]=4 68 B9R1.6 CC(O)C1CNCCN1 MCULE-7562437820 [0,0,0,0,0,0|2,0,1]=3 69 B9R1.6 CC(O)C1CNCCO1 MCULE-5611108274 [0,0,0,0,0,0|2,0,1]=3 70 B9R1.6 CC(S)C1CCCCC1 MCULE-3622234308 [0,0,0,0,0,0|2,1,1]=4 71 B9R1.6 CN(C)C1CCCCC1 MCULE-9944021193 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.6 CN(C)C1CCCNC1 MCULE-2507156016 [0,0,0,0,0,0|3,0,0]=3 73 B9R1.6 CN(C)C1CCCNC1 MCULE-4726710621 [0,0,0,0,0,0|3,0,0]=3 74 B9R1.6 CN(C)C1CCCNC1 MCULE-8192090196 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.6 CN(C)[C@@H]1CCCNC1 MCULE-3117033891 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.6 CN(C)[C@@H]1CCCNC1 MCULE-3433860021 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.6 CN(C)[C@@H]1CCCNC1 MCULE-7967986839 [0,0,0,0,0,0|3,0,0]=3 78 B9R1.6 CN(C)[C@@H]1CCCNC1 MCULE-9733645508 [0,0,0,0,0,0|3,0,0]=3 79 B9R1.6 CN(C)[C@H]1CCCNC1 MCULE-2048376736 [0,0,0,0,0,0|3,0,0]=3 80 B9R1.6 CN(C)[C@H]1CCCNC1 MCULE-4179265071 [0,0,0,0,0,0|3,0,0]=3 81 B9R1.6 CN(C)[C@H]1CCCNC1 MCULE-5589454551 [0,0,0,0,0,0|3,0,0]=3 82 B9R1.6 CN(C)[C@H]1CCCNC1 MCULE-6240633757 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.6 CN(C)[C@H]1CCCNC1 MCULE-6495801290 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.6 CN(C)[C@H]1CCCNC1 MCULE-6932798912 [0,0,0,0,0,0|3,0,0]=3 85 B9R1.6 CN(N)C1CCCCC1 MCULE-6781931520 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.6 CN(N)C1CCCCC1 MCULE-9101477929 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.6 CS(=O)C1CCCCC1 MCULE-4263908685 [0,0,0,0,0,0|3,0,0]=3 88 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-3071844374 [0,0,0,0,0,0|3,0,1]=4 89 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-6526660266 [0,0,0,0,0,0|3,0,1]=4 90 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8321480556 [0,0,0,0,0,0|3,0,1]=4 91 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8767179050 [0,0,0,0,0,0|3,0,1]=4 92 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-4304404236 [0,0,0,0,0,0|2,0,1]=3 93 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-7854211857 [0,0,0,0,0,0|2,0,1]=3 94 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-1752623068 [0,0,0,0,0,0|3,0,1]=4 95 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-2316047131 [0,0,0,0,0,0|3,0,1]=4 96 B9R1.6 C[C@@H](O)C1CCNCC1 MCULE-9451593770 [0,0,0,0,0,0|3,0,1]=4 97 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-1246138653 [0,0,0,0,0,0|3,0,1]=4 98 B9R1.6 C[C@@H](O)C1CCOCC1 MCULE-5178620559 [0,0,0,0,0,0|3,0,1]=4 99 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-2168214783 [0,0,0,0,0,0|2,0,1]=3 100 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-8290718551 [0,0,0,0,0,0|2,0,1]=3 101 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-1031735669 [0,0,0,0,0,0|3,0,1]=4 102 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-3061879771 [0,0,0,0,0,0|3,0,1]=4 103 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-7933942708 [0,0,0,0,0,0|3,0,1]=4 104 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-8070329731 [0,0,0,0,0,0|3,0,1]=4 105 B9R1.6 C[C@H](O)C1CCCCC1 MCULE-9702860419 [0,0,0,0,0,0|2,0,1]=3 106 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-2198012011 [0,0,0,0,0,0|3,0,1]=4 107 B9R1.6 C[C@H](O)C1CCNCC1 MCULE-7131345979 [0,0,0,0,0,0|3,0,1]=4 108 B9R1.6 C[C@H](O)C1CCOCC1 MCULE-4135856134 [0,0,0,0,0,0|3,0,1]=4 109 B9R1.6 ClP(Cl)C1CCCCC1 MCULE-8061900227 [0,0,0,0,0,0|4,0,0]=4 110 B9R1.6 FC(F)C1CCCNC1 MCULE-2933665620 [0,0,0,0,0,0|2,0,1]=3 111 B9R1.6 FC(F)C1CCCNC1 MCULE-4136923385 [0,0,0,0,0,0|2,0,1]=3 112 B9R1.6 FC(F)C1CNCCO1 MCULE-3085847203 [0,0,0,0,0,0|3,0,1]=4 113 B9R1.6 FC(F)C1CNCCO1 MCULE-7955903734 [0,0,0,0,0,0|3,0,1]=4 114 B9R1.6 FC(F)[C@H]1CNCCN1 MCULE-2267746996 [0,0,0,0,0,0|3,0,1]=4 115 B9R1.6 FC(F)[C@H]1CNCCN1 MCULE-9968961338 [0,0,0,0,0,0|3,0,1]=4 116 B9R1.6 N=C(N)C1CC=CCC1 MCULE-5710970221 [0,0,0,0,0,0|3,0,1]=4 117 B9R1.6 N=C(N)C1CC=CCC1 MCULE-9208549422 [0,0,0,0,0,0|3,0,1]=4 118 B9R1.6 N=C(N)C1CCCCC1 MCULE-3107787417 [0,0,0,0,0,0|3,0,0]=3 119 B9R1.6 N=C(N)C1CCCCC1 MCULE-9030561972 [0,0,0,0,0,0|3,0,0]=3 120 B9R1.6 N=C(N)C1CCCCN1 MCULE-3219883116 [0,0,0,0,0,0|4,0,0]=4 121 B9R1.6 N=C(N)C1CCCCN1 MCULE-8067475683 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.6 N=C(N)C1CCCNC1 MCULE-1952956995 [0,0,0,0,0,0|2,0,0]=2 123 B9R1.6 N=C(N)C1CCCNC1 MCULE-5965162460 [0,0,0,0,0,0|2,0,0]=2 124 B9R1.6 N=C(N)C1CCNCC1 MCULE-5469691156 [0,0,0,0,0,0|4,0,0]=4 125 B9R1.6 N=C(N)C1CCNCC1 MCULE-5841148719 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.6 N=C(N)C1CCOCC1 MCULE-5311101584 [0,0,0,0,0,0|4,0,0]=4 127 B9R1.6 N=C(N)C1CCOCC1 MCULE-9918917702 [0,0,0,0,0,0|4,0,0]=4 128 B9R1.6 N=C(N)N1CCCCC1 MCULE-1949406939 [0,0,0,0,0,0|4,0,0]=4 129 B9R1.6 N=C(N)N1CCCCC1 MCULE-4074763290 [0,0,0,0,0,0|4,0,0]=4 130 B9R1.6 N=C(N)N1CCCCC1 MCULE-4391511847 [0,0,0,0,0,0|4,0,0]=4 131 B9R1.6 N=C(N)N1CCCCC1 MCULE-6020071553 [0,0,0,0,0,0|4,0,0]=4 132 B9R1.6 N=C(N)N1CCCCC1 MCULE-6436130948 [0,0,0,0,0,0|4,0,0]=4 133 B9R1.6 N=C(N)N1CCCCC1 MCULE-7924235577 [0,0,0,0,0,0|4,0,0]=4 134 B9R1.6 NC(=O)C1=CNCCC1 MCULE-5396085408 [0,0,0,0,0,0|1,0,2]=3 135 B9R1.6 NC(=O)C1=COCCC1 MCULE-1179770781 [0,0,0,0,0,0|2,0,2]=4 136 B9R1.6 NC(=O)C1CC=CCC1 MCULE-5613786218 [0,0,0,0,0,0|2,0,1]=3 137 B9R1.6 NC(=O)C1CCCCC1 MCULE-8611311863 [0,0,0,0,0,0|2,0,0]=2 138 B9R1.6 NC(=O)C1CCCCN1 MCULE-2544126054 [0,0,0,0,0,0|3,0,0]=3 139 B9R1.6 NC(=O)C1CCCCN1 MCULE-6661716686 [0,0,0,0,0,0|3,0,0]=3 140 B9R1.6 NC(=O)C1CCCNC1 MCULE-1833696438 [0,0,0,0,0,0|1,0,0]=1 141 B9R1.6 NC(=O)C1CCCNC1 MCULE-5902080067 [0,0,0,0,0,0|1,0,0]=1 142 B9R1.6 NC(=O)C1CCCOC1 MCULE-3754898627 [0,0,0,0,0,0|2,0,0]=2 143 B9R1.6 NC(=O)C1CCNCC1 MCULE-8206211805 [0,0,0,0,0,0|3,0,0]=3 144 B9R1.6 NC(=O)C1CCNCC1 MCULE-8840746533 [0,0,0,0,0,0|3,0,0]=3 145 B9R1.6 NC(=O)C1CCOCC1 MCULE-1626473774 [0,0,0,0,0,0|3,0,0]=3 146 B9R1.6 NC(=O)C1CNCCN1 MCULE-6032361805 [0,0,0,0,0,0|2,0,0]=2 147 B9R1.6 NC(=O)C1CNCCN1 MCULE-7459621704 [0,0,0,0,0,0|2,0,0]=2 148 B9R1.6 NC(=O)C1CNCCO1 MCULE-7045289444 [0,0,0,0,0,0|2,0,0]=2 149 B9R1.6 NC(=O)C1CNCCO1 MCULE-8403360257 [0,0,0,0,0,0|2,0,0]=2 150 B9R1.6 NC(=O)C1CNCCO1 MCULE-8477654103 [0,0,0,0,0,0|2,0,0]=2 151 B9R1.6 NC(=O)C1COCCN1 MCULE-3997305592 [0,0,0,0,0,0|3,0,0]=3 152 B9R1.6 NC(=O)C1COCCN1 MCULE-8679226087 [0,0,0,0,0,0|3,0,0]=3 153 B9R1.6 NC(=O)C1CSCCN1 MCULE-5519659168 [0,0,0,0,0,0|3,0,0]=3 154 B9R1.6 NC(=O)N1CCCCC1 MCULE-9935688246 [0,0,0,0,0,0|3,0,0]=3 155 B9R1.6 NC(=O)N1CCNCC1 MCULE-2703076090 [0,0,0,0,0,0|4,0,0]=4 156 B9R1.6 NC(=O)N1CCNCC1 MCULE-9778565861 [0,0,0,0,0,0|4,0,0]=4 157 B9R1.6 NC(=O)N1CCOCC1 MCULE-2181195591 [0,0,0,0,0,0|4,0,0]=4 158 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-1302948446 [0,0,0,0,0,0|1,0,0]=1 159 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-3790099707 [0,0,0,0,0,0|1,0,0]=1 160 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-4105759578 [0,0,0,0,0,0|1,0,0]=1 161 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-6022899132 [0,0,0,0,0,0|1,0,0]=1 162 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3203472135 [0,0,0,0,0,0|2,0,0]=2 163 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3866777440 [0,0,0,0,0,0|2,0,0]=2 164 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-6105431602 [0,0,0,0,0,0|2,0,0]=2 165 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-7727900968 [0,0,0,0,0,0|2,0,0]=2 166 B9R1.6 NC(=O)[C@H]1CCCCN1 MCULE-5554529404 [0,0,0,0,0,0|3,0,0]=3 167 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-3568267883 [0,0,0,0,0,0|1,0,0]=1 168 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-6403292667 [0,0,0,0,0,0|1,0,0]=1 169 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-7433087477 [0,0,0,0,0,0|1,0,0]=1 170 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-9069766695 [0,0,0,0,0,0|1,0,0]=1 171 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-1527418805 [0,0,0,0,0,0|2,0,0]=2 172 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-6529490056 [0,0,0,0,0,0|2,0,0]=2 173 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-9894216692 [0,0,0,0,0,0|2,0,0]=2 174 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-1904729907 [0,0,0,0,0,0|3,0,0]=3 175 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7069433109 [0,0,0,0,0,0|3,0,0]=3 176 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7970834070 [0,0,0,0,0,0|3,0,0]=3 177 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-9117686776 [0,0,0,0,0,0|3,0,0]=3 178 B9R1.6 NC(=S)C1CCCCC1 MCULE-8109334870 [0,0,0,0,0,0|2,1,0]=3 179 B9R1.6 NC(=S)C1CCCOC1 MCULE-7147213341 [0,0,0,0,0,0|2,1,0]=3 180 B9R1.6 NC(=S)C1CCNCC1 MCULE-6109847413 [0,0,0,0,0,0|3,1,0]=4 181 B9R1.6 NC(=S)C1CCOCC1 MCULE-6355388595 [0,0,0,0,0,0|3,1,0]=4 182 B9R1.6 NC(=S)C1CSCCS1 MCULE-2847991371 [0,0,0,0,0,0|3,1,0]=4 183 B9R1.6 NC(=S)N1CCCCC1 MCULE-1564707293 [0,0,0,0,0,0|3,1,0]=4 184 B9R1.6 O=C(Cl)C1=CCCCC1 MCULE-8228686007 [0,0,0,0,0,0|2,0,2]=4 185 B9R1.6 O=C(Cl)C1CC=CCC1 MCULE-2173469232 [0,0,0,0,0,0|2,0,1]=3 186 B9R1.6 O=C(Cl)C1CCCCC1 MCULE-5867897390 [0,0,0,0,0,0|2,0,0]=2 187 B9R1.6 O=C(Cl)C1CCCCO1 MCULE-2871405989 [0,0,0,0,0,0|3,0,0]=3 188 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-6549888109 [0,0,0,0,0,0|3,0,0]=3 189 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-7154842850 [0,0,0,0,0,0|3,0,0]=3 190 B9R1.6 O=C(Cl)C1CCOCC1 MCULE-5435965006 [0,0,0,0,0,0|3,0,0]=3 191 B9R1.6 O=C(Cl)C1CCSCC1 MCULE-2089111376 [0,0,0,0,0,0|3,0,0]=3 192 B9R1.6 O=C(Cl)N1CC=CCC1 MCULE-3457683223 [0,0,0,0,0,0|3,0,1]=4 193 B9R1.6 O=C(Cl)N1CCCCC1 MCULE-8197895576 [0,0,0,0,0,0|3,0,0]=3 194 B9R1.6 O=C(Cl)N1CCOCC1 MCULE-6303586319 [0,0,0,0,0,0|4,0,0]=4 195 B9R1.6 O=C(Cl)N1CCSCC1 MCULE-7153763312 [0,0,0,0,0,0|4,0,0]=4 196 B9R1.6 O=C(F)N1CCNCC1 MCULE-3929907191 [0,0,0,0,0,0|4,0,0]=4 197 B9R1.6 O=C(F)N1CCNCC1 MCULE-8030550291 [0,0,0,0,0,0|4,0,0]=4 198 B9R1.6 O=C(O)C1=CCCCC1 MCULE-1482472372 [0,0,0,0,0,0|1,0,2]=3 199 B9R1.6 O=C(O)C1=CCCCO1 MCULE-8158964792 [0,0,0,0,0,0|2,0,2]=4 200 B9R1.6 O=C(O)C1=CCCNC1 MCULE-7878143035 [0,0,0,0,0,0|0,0,2]=2 201 B9R1.6 O=C(O)C1=CCCNC1 MCULE-9382105537 [0,0,0,0,0,0|0,0,2]=2 202 B9R1.6 O=C(O)C1=CCCOC1 MCULE-4597846034 [0,0,0,0,0,0|1,0,2]=3 203 B9R1.6 O=C(O)C1=CCCSC1 MCULE-6991730217 [0,0,0,0,0,0|1,0,2]=3 204 B9R1.6 O=C(O)C1=CCNCC1 MCULE-7813592729 [0,0,0,0,0,0|2,0,2]=4 205 B9R1.6 O=C(O)C1=CCNCC1 MCULE-9446043448 [0,0,0,0,0,0|2,0,2]=4 206 B9R1.6 O=C(O)C1=CCOCC1 MCULE-8602474600 [0,0,0,0,0,0|2,0,2]=4 207 B9R1.6 O=C(O)C1=COCCC1 MCULE-4203786677 [0,0,0,0,0,0|1,0,2]=3 208 B9R1.6 O=C(O)C1=COCCO1 MCULE-9406944236 [0,0,0,0,0,0|2,0,2]=4 209 B9R1.6 O=C(O)C1=NNCCC1 MCULE-7500831474 [0,0,0,0,0,0|1,0,1]=2 210 B9R1.6 O=C(O)C1C=CCC=C1 MCULE-1209088345 [0,0,0,0,0,0|1,0,3]=4 211 B9R1.6 O=C(O)C1C=CCCC1 MCULE-7827178223 [0,0,0,0,0,0|1,0,1]=2 212 B9R1.6 O=C(O)C1CC=CCC1 MCULE-6262725586 [0,0,0,0,0,0|1,0,1]=2 213 B9R1.6 O=C(O)C1CC=CCO1 MCULE-5751437850 [0,0,0,0,0,0|2,0,1]=3 214 B9R1.6 O=C(O)C1CCC=CO1 MCULE-6447977583 [0,0,0,0,0,0|2,0,1]=3 215 B9R1.6 O=C(O)C1CCCCC1 MCULE-2193918964 [0,0,0,0,0,0|1,0,0]=1 216 B9R1.6 O=C(O)C1CCCCN1 MCULE-3485439173 [0,0,0,0,0,0|2,0,0]=2 217 B9R1.6 O=C(O)C1CCCCN1 MCULE-4576094783 [0,0,0,0,0,0|2,0,0]=2 218 B9R1.6 O=C(O)C1CCCCN1 MCULE-4851525706 [0,0,0,0,0,0|2,0,0]=2 219 B9R1.6 O=C(O)C1CCCCN1 MCULE-6801625058 [0,0,0,0,0,0|2,0,0]=2 220 B9R1.6 O=C(O)C1CCCCO1 MCULE-8947688342 [0,0,0,0,0,0|2,0,0]=2 221 B9R1.6 O=C(O)C1CCCCS1 MCULE-6466357833 [0,0,0,0,0,0|2,0,0]=2 222 B9R1.6 O=C(O)C1CCCNC1 MCULE-3189529983 [0,0,0,0,0,0|0,0,0]=0 223 B9R1.6 O=C(O)C1CCCNC1 MCULE-5698100100 [0,0,0,0,0,0|0,0,0]=0 224 B9R1.6 O=C(O)C1CCCNC1 MCULE-9486003126 [0,0,0,0,0,0|0,0,0]=0 225 B9R1.6 O=C(O)C1CCCNN1 MCULE-1480488255 [0,0,0,0,0,0|1,0,0]=1 226 B9R1.6 O=C(O)C1CCCNN1 MCULE-3054116225 [0,0,0,0,0,0|1,0,0]=1 227 B9R1.6 O=C(O)C1CCCOC1 MCULE-3431951803 [0,0,0,0,0,0|1,0,0]=1 228 B9R1.6 O=C(O)C1CCCSC1 MCULE-1777528306 [0,0,0,0,0,0|1,0,0]=1 229 B9R1.6 O=C(O)C1CCNCC1 MCULE-5699874022 [0,0,0,0,0,0|2,0,0]=2 230 B9R1.6 O=C(O)C1CCNCC1 MCULE-7477545245 [0,0,0,0,0,0|2,0,0]=2 231 B9R1.6 O=C(O)C1CCOCC1 MCULE-4725122837 [0,0,0,0,0,0|2,0,0]=2 232 B9R1.6 O=C(O)C1CCOCN1 MCULE-2724570105 [0,0,0,0,0,0|3,0,0]=3 233 B9R1.6 O=C(O)C1CCOCN1 MCULE-7891527992 [0,0,0,0,0,0|3,0,0]=3 234 B9R1.6 O=C(O)C1CCSCC1 MCULE-5031108601 [0,0,0,0,0,0|2,0,0]=2 235 B9R1.6 O=C(O)C1CCSCN1 MCULE-7351632016 [0,0,0,0,0,0|3,0,0]=3 236 B9R1.6 O=C(O)C1CCSCN1 MCULE-7786919982 [0,0,0,0,0,0|3,0,0]=3 237 B9R1.6 O=C(O)C1CNCCN1 MCULE-2689074129 [0,0,0,0,0,0|1,0,0]=1 238 B9R1.6 O=C(O)C1CNCCN1 MCULE-4697614875 [0,0,0,0,0,0|1,0,0]=1 239 B9R1.6 O=C(O)C1CNCCN1 MCULE-7015381558 [0,0,0,0,0,0|1,0,0]=1 240 B9R1.6 O=C(O)C1CNCCO1 MCULE-1106448255 [0,0,0,0,0,0|1,0,0]=1 241 B9R1.6 O=C(O)C1CNCCO1 MCULE-5402647836 [0,0,0,0,0,0|1,0,0]=1 242 B9R1.6 O=C(O)C1CNCCO1 MCULE-5647993069 [0,0,0,0,0,0|1,0,0]=1 243 B9R1.6 O=C(O)C1CNCCO1 MCULE-6949638629 [0,0,0,0,0,0|1,0,0]=1 244 B9R1.6 O=C(O)C1CNCCS1 MCULE-3981762124 [0,0,0,0,0,0|1,0,0]=1 245 B9R1.6 O=C(O)C1CNCCS1 MCULE-4631923202 [0,0,0,0,0,0|1,0,0]=1 246 B9R1.6 O=C(O)C1COCCN1 MCULE-2235592409 [0,0,0,0,0,0|2,0,0]=2 247 B9R1.6 O=C(O)C1COCCN1 MCULE-6865044459 [0,0,0,0,0,0|2,0,0]=2 248 B9R1.6 O=C(O)C1COCCO1 MCULE-3887767361 [0,0,0,0,0,0|2,0,0]=2 249 B9R1.6 O=C(O)C1COCCO1 MCULE-6027603960 [0,0,0,0,0,0|2,0,0]=2 250 B9R1.6 O=C(O)C1COCOC1 MCULE-4867087023 [0,0,0,0,0,0|2,0,0]=2 251 B9R1.6 O=C(O)C1CSCCN1 MCULE-4003309722 [0,0,0,0,0,0|2,0,0]=2 252 B9R1.6 O=C(O)C1CSCCN1 MCULE-5519716572 [0,0,0,0,0,0|2,0,0]=2 253 B9R1.6 O=C(O)C1CSCCS1 MCULE-6267524662 [0,0,0,0,0,0|2,0,0]=2 254 B9R1.6 O=C(O)C1NCCCS1 MCULE-7316372918 [0,0,0,0,0,0|3,0,0]=3 255 B9R1.6 O=C(O)C1OCCCO1 MCULE-6505925267 [0,0,0,0,0,0|3,0,0]=3 256 B9R1.6 O=C(O)C1SCCCS1 MCULE-6447130734 [0,0,0,0,0,0|3,0,0]=3 257 B9R1.6 O=C(O)C1SCSCS1 MCULE-6847986458 [0,0,0,0,0,0|4,0,0]=4 258 B9R1.6 O=C(O)N1CCCCC1 MCULE-2727154893 [0,0,0,0,0,0|2,0,0]=2 259 B9R1.6 O=C(O)N1CCCCC1 MCULE-4559010344 [0,0,0,0,0,0|2,0,0]=2 260 B9R1.6 O=C(O)N1CCNCC1 MCULE-3508385346 [0,0,0,0,0,0|3,0,0]=3 261 B9R1.6 O=C(O)N1CCOCC1 MCULE-7938310937 [0,0,0,0,0,0|3,0,0]=3 262 B9R1.6 O=C(O)N1CCSCC1 MCULE-4867596495 [0,0,0,0,0,0|3,0,0]=3 263 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-1597942572 [0,0,0,0,0,0|1,0,1]=2 264 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-6215840629 [0,0,0,0,0,0|1,0,1]=2 265 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-3257537289 [0,0,0,0,0,0|2,0,0]=2 266 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-7236775885 [0,0,0,0,0,0|2,0,0]=2 267 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-8859089797 [0,0,0,0,0,0|2,0,0]=2 268 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-9674307172 [0,0,0,0,0,0|2,0,0]=2 269 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-4995364653 [0,0,0,0,0,0|2,0,0]=2 270 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-8767901302 [0,0,0,0,0,0|2,0,0]=2 271 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-3206278693 [0,0,0,0,0,0|0,0,0]=0 272 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-5509362549 [0,0,0,0,0,0|0,0,0]=0 273 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-8357747886 [0,0,0,0,0,0|0,0,0]=0 274 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-9156802088 [0,0,0,0,0,0|0,0,0]=0 275 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-1404699605 [0,0,0,0,0,0|1,0,0]=1 276 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-4463982289 [0,0,0,0,0,0|1,0,0]=1 277 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-6113826647 [0,0,0,0,0,0|1,0,0]=1 278 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-8270310960 [0,0,0,0,0,0|1,0,0]=1 279 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-9211958407 [0,0,0,0,0,0|1,0,0]=1 280 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-2545046706 [0,0,0,0,0,0|1,0,0]=1 281 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-5694807182 [0,0,0,0,0,0|1,0,0]=1 282 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7177432982 [0,0,0,0,0,0|1,0,0]=1 283 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7413709257 [0,0,0,0,0,0|1,0,0]=1 284 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-3078161658 [0,0,0,0,0,0|1,0,0]=1 285 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-4550123668 [0,0,0,0,0,0|1,0,0]=1 286 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7218215777 [0,0,0,0,0,0|1,0,0]=1 287 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7983160968 [0,0,0,0,0,0|1,0,0]=1 288 B9R1.6 O=C(O)[C@@H]1CNCCS1 MCULE-6650545170 [0,0,0,0,0,0|1,0,0]=1 289 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-1789021231 [0,0,0,0,0,0|2,0,0]=2 290 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-4026574279 [0,0,0,0,0,0|2,0,0]=2 291 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-7736477261 [0,0,0,0,0,0|2,0,0]=2 292 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-8166049277 [0,0,0,0,0,0|2,0,0]=2 293 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-3560012987 [0,0,0,0,0,0|2,0,0]=2 294 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-8883141087 [0,0,0,0,0,0|2,0,0]=2 295 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-3905601111 [0,0,0,0,0,0|2,0,0]=2 296 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9668825603 [0,0,0,0,0,0|2,0,0]=2 297 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9675980130 [0,0,0,0,0,0|2,0,0]=2 298 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-5009469360 [0,0,0,0,0,0|1,0,1]=2 299 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-9797420475 [0,0,0,0,0,0|1,0,1]=2 300 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8281618311 [0,0,0,0,0,0|2,0,0]=2 301 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8486513131 [0,0,0,0,0,0|2,0,0]=2 302 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9333123477 [0,0,0,0,0,0|2,0,0]=2 303 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9786740249 [0,0,0,0,0,0|2,0,0]=2 304 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-2856988466 [0,0,0,0,0,0|2,0,0]=2 305 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-8960602925 [0,0,0,0,0,0|2,0,0]=2 306 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-5644771403 [0,0,0,0,0,0|0,0,0]=0 307 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-6473613352 [0,0,0,0,0,0|0,0,0]=0 308 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-7395918259 [0,0,0,0,0,0|0,0,0]=0 309 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-8202628107 [0,0,0,0,0,0|0,0,0]=0 310 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-5460978548 [0,0,0,0,0,0|1,0,0]=1 311 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-6296084302 [0,0,0,0,0,0|1,0,0]=1 312 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-3913162278 [0,0,0,0,0,0|1,0,0]=1 313 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-4021468329 [0,0,0,0,0,0|1,0,0]=1 314 B9R1.6 O=C(O)[C@H]1CCCSC1 MCULE-1373166628 [0,0,0,0,0,0|1,0,0]=1 315 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-2073761586 [0,0,0,0,0,0|1,0,0]=1 316 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-3099021896 [0,0,0,0,0,0|1,0,0]=1 317 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-5862899979 [0,0,0,0,0,0|1,0,0]=1 318 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-8591926633 [0,0,0,0,0,0|1,0,0]=1 319 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-9781518658 [0,0,0,0,0,0|1,0,0]=1 320 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-1051281674 [0,0,0,0,0,0|1,0,0]=1 321 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-2477891803 [0,0,0,0,0,0|1,0,0]=1 322 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-5182952887 [0,0,0,0,0,0|1,0,0]=1 323 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-6051376580 [0,0,0,0,0,0|1,0,0]=1 324 B9R1.6 O=C(O)[C@H]1CNCCS1 MCULE-7818958113 [0,0,0,0,0,0|1,0,0]=1 325 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-2388461804 [0,0,0,0,0,0|2,0,0]=2 326 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-3810653827 [0,0,0,0,0,0|2,0,0]=2 327 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-6589310258 [0,0,0,0,0,0|2,0,0]=2 328 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-9158991594 [0,0,0,0,0,0|2,0,0]=2 329 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-6591475838 [0,0,0,0,0,0|2,0,0]=2 330 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-9849453248 [0,0,0,0,0,0|2,0,0]=2 331 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-2174373928 [0,0,0,0,0,0|2,0,0]=2 332 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-5936347595 [0,0,0,0,0,0|2,0,0]=2 333 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-8464504119 [0,0,0,0,0,0|2,0,0]=2 334 B9R1.6 O=C([O-])C1CCC=CO1 MCULE-8478897142 [0,0,0,0,0,0|2,0,2]=4 335 B9R1.6 O=C([O-])C1CCCCC1 MCULE-2430887278 [0,0,0,0,0,0|1,0,1]=2 336 B9R1.6 O=C([O-])C1CCCCN1 MCULE-2358540296 [0,0,0,0,0,0|2,0,1]=3 337 B9R1.6 O=N(=O)C1CCCCC1 MCULE-6198799449 [0,0,0,0,0,0|2,0,1]=3 338 B9R1.6 O=N(=O)C1CCNCC1 MCULE-1396847158 [0,0,0,0,0,0|3,0,1]=4 339 B9R1.6 O=N(=O)C1CCNCC1 MCULE-2863786986 [0,0,0,0,0,0|3,0,1]=4 340 B9R1.6 O=N(=O)C1CCOCC1 MCULE-8523674594 [0,0,0,0,0,0|3,0,1]=4 341 B9R1.6 O=S(O)C1CCCCC1 MCULE-2447383910 [0,0,0,0,0,0|2,0,0]=2 342 B9R1.6 O=S([O-])C1CCCCC1 MCULE-4340070525 [0,0,0,0,0,0|2,0,1]=3 343 B9R1.6 O=S([O-])C1CCOCC1 MCULE-4319852593 [0,0,0,0,0,0|3,0,1]=4 344 B9R1.6 O=S([O-])C1CCOCC1 MCULE-7056046306 [0,0,0,0,0,0|3,0,1]=4 345 B9R1.6 OB(O)C1CCCCC1 MCULE-7463281328 [0,0,0,0,0,0|2,0,1]=3 346 B9R1.6 OB(O)C1CCCNC1 MCULE-9145993336 [0,0,0,0,0,0|1,0,1]=2 347 B9R1.6 OB(O)C1CCCOC1 MCULE-5502913518 [0,0,0,0,0,0|2,0,1]=3 348 B9R1.6 OB(O)C1CCNCC1 MCULE-6477872801 [0,0,0,0,0,0|3,0,1]=4 349 B9R1.6 OB(O)C1CCNCC1 MCULE-6629356175 [0,0,0,0,0,0|3,0,1]=4 350 B9R1.6 OB(O)C1CCOCC1 MCULE-5917553399 [0,0,0,0,0,0|3,0,1]=4 351 B9R1.6 S=C(S)N1CCCCC1 MCULE-3707818588 [0,0,0,0,0,0|2,2,0]=4 352 B9R1.6 S=C(S)N1CCCCC1 MCULE-9173625423 [0,0,0,0,0,0|2,2,0]=4 353 B9R1.6 [C@H]1(CSCCN1)C(=O)O MCULE-2592294388 [0,0,0,0,0,0|2,0,0]=2 354 B9R1.6 [NH2+]=C(N)N1CCCCC1 MCULE-2030047624 [0,0,0,0,0,0|4,0,0]=4 355 B8R1.2 BrC=C1CCCCC1 MCULE-1203677785 [1,0,0,0,0,0|2,0,1]=4 356 B8R1.2 BrCC1CCCCC1 MCULE-1732610761 [1,0,0,0,0,0|2,0,1]=4 357 B8R1.2 BrCC1CCCNC1 MCULE-1688987947 [1,0,0,0,0,0|1,0,1]=3 358 B8R1.2 BrCC1CCCNC1 MCULE-4639020810 [1,0,0,0,0,0|1,0,1]=3 359 B8R1.2 BrCC1CCCNC1 MCULE-8872043199 [1,0,0,0,0,0|1,0,1]=3 360 B8R1.2 BrCC1CCCOC1 MCULE-8233955986 [1,0,0,0,0,0|2,0,1]=4 361 B8R1.2 BrCC1CNCCO1 MCULE-4182788522 [1,0,0,0,0,0|2,0,1]=4 362 B8R1.2 BrCC1CNCCO1 MCULE-4827459875 [1,0,0,0,0,0|2,0,1]=4 363 B8R1.2 BrC[C@H]1CCCOC1 MCULE-4617251201 [1,0,0,0,0,0|2,0,1]=4 364 B8R1.2 C#CC1CCCCC1 MCULE-1010712187 [1,0,0,0,0,0|2,0,1]=4 365 B8R1.2 C#CC1CCCNC1 MCULE-1179885650 [1,0,0,0,0,0|1,0,1]=3 366 B8R1.2 C#CC1CCCNC1 MCULE-6709114437 [1,0,0,0,0,0|1,0,1]=3 367 B8R1.2 C#CC1CCCOC1 MCULE-3580388819 [1,0,0,0,0,0|2,0,1]=4 368 B8R1.2 C#CC1CNCCO1 MCULE-5920372974 [1,0,0,0,0,0|2,0,1]=4 369 B8R1.2 C#C[C@H]1CCCNC1 MCULE-3215954588 [1,0,0,0,0,0|1,0,1]=3 370 B8R1.2 C#C[C@H]1CCCNC1 MCULE-6736017757 [1,0,0,0,0,0|1,0,1]=3 371 B8R1.2 C1(CCCCN1)CO MCULE-7414417382 [1,0,0,0,0,0|2,0,1]=4 372 B8R1.2 C1(CCCNC1)C#N MCULE-1172317679 [1,0,0,0,0,0|1,0,1]=3 373 B8R1.2 C1(CCCNC1)C#N MCULE-9972435731 [1,0,0,0,0,0|1,0,1]=3 374 B8R1.2 C1(CCCNC1)OC MCULE-1114013355 [1,0,0,0,0,0|2,0,0]=3 375 B8R1.2 C1(CCCNC1)OC MCULE-4203507585 [1,0,0,0,0,0|2,0,0]=3 376 B8R1.2 C1(CCCOC1)CN MCULE-9009856435 [1,0,0,0,0,0|2,0,1]=4 377 B8R1.2 C1(CNCCN1)CC MCULE-2886979448 [1,0,0,0,0,0|2,0,1]=4 378 B8R1.2 C=CC1CC=CCC1 MCULE-1027409234 [1,0,0,0,0,0|2,0,1]=4 379 B8R1.2 C=CC1CCCCC1 MCULE-5657998956 [1,0,0,0,0,0|2,0,0]=3 380 B8R1.2 C=CC1CCCCN1 MCULE-1327502475 [1,0,0,0,0,0|3,0,0]=4 381 B8R1.2 C=CC1CCCCN1 MCULE-7059257921 [1,0,0,0,0,0|3,0,0]=4 382 B8R1.2 C=CC1CCCNC1 MCULE-4200920592 [1,0,0,0,0,0|1,0,0]=2 383 B8R1.2 C=CC1CCCNC1 MCULE-5849078027 [1,0,0,0,0,0|1,0,0]=2 384 B8R1.2 C=CC1CCNCC1 MCULE-1082479185 [1,0,0,0,0,0|3,0,0]=4 385 B8R1.2 C=CC1CCNCC1 MCULE-1750757751 [1,0,0,0,0,0|3,0,0]=4 386 B8R1.2 CC=C1CCCCC1 MCULE-6327883518 [1,0,0,0,0,0|2,0,1]=4 387 B8R1.2 CCC1CCCCC1 MCULE-9302115958 [1,0,0,0,0,0|2,0,1]=4 388 B8R1.2 CCC1CCCNC1 MCULE-1867940470 [1,0,0,0,0,0|1,0,1]=3 389 B8R1.2 CCC1CCCNC1 MCULE-4023638399 [1,0,0,0,0,0|1,0,1]=3 390 B8R1.2 CCC1CNCCN1 MCULE-1309315605 [1,0,0,0,0,0|2,0,1]=4 391 B8R1.2 CCC1CNCCN1 MCULE-3991328634 [1,0,0,0,0,0|2,0,1]=4 392 B8R1.2 CCC1CNCCN1 MCULE-5654677429 [1,0,0,0,0,0|2,0,1]=4 393 B8R1.2 CCC1CNCCN1 MCULE-7054869584 [1,0,0,0,0,0|2,0,1]=4 394 B8R1.2 CCC1CNCCO1 MCULE-1491754999 [1,0,0,0,0,0|2,0,1]=4 395 B8R1.2 CCC1CNCCO1 MCULE-2804411387 [1,0,0,0,0,0|2,0,1]=4 396 B8R1.2 CCC1CNCCS1 MCULE-4342438029 [1,0,0,0,0,0|2,0,1]=4 397 B8R1.2 CC[C@@H]1CNCCN1 MCULE-5846905567 [1,0,0,0,0,0|2,0,1]=4 398 B8R1.2 CC[C@@H]1CNCCN1 MCULE-7624605206 [1,0,0,0,0,0|2,0,1]=4 399 B8R1.2 CC[C@@H]1CNCCN1 MCULE-9661707516 [1,0,0,0,0,0|2,0,1]=4 400 B8R1.2 CC[C@@H]1CNCCN1 MCULE-9767062288 [1,0,0,0,0,0|2,0,1]=4 401 B8R1.2 CC[C@@H]1CNCCO1 MCULE-5576287129 [1,0,0,0,0,0|2,0,1]=4 402 B8R1.2 CC[C@@H]1CNCCO1 MCULE-7329824991 [1,0,0,0,0,0|2,0,1]=4 403 B8R1.2 CC[C@H]1CNCCN1 MCULE-1904360840 [1,0,0,0,0,0|2,0,1]=4 404 B8R1.2 CC[C@H]1CNCCN1 MCULE-3445783000 [1,0,0,0,0,0|2,0,1]=4 405 B8R1.2 CC[C@H]1CNCCN1 MCULE-3843396321 [1,0,0,0,0,0|2,0,1]=4 406 B8R1.2 CC[C@H]1CNCCN1 MCULE-8055405480 [1,0,0,0,0,0|2,0,1]=4 407 B8R1.2 CC[C@H]1CNCCO1 MCULE-1213088635 [1,0,0,0,0,0|2,0,1]=4 408 B8R1.2 CC[C@H]1CNCCO1 MCULE-1732774154 [1,0,0,0,0,0|2,0,1]=4 409 B8R1.2 CC[C@H]1CNCCO1 MCULE-2604595853 [1,0,0,0,0,0|2,0,1]=4 410 B8R1.2 CC[C@H]1CNCCO1 MCULE-6508226283 [1,0,0,0,0,0|2,0,1]=4 411 B8R1.2 CNC1CCCCC1 MCULE-8593678924 [1,0,0,0,0,0|3,0,0]=4 412 B8R1.2 CNC1CCCNC1 MCULE-4055178365 [1,0,0,0,0,0|2,0,0]=3 413 B8R1.2 CNC1CCCNC1 MCULE-6973115629 [1,0,0,0,0,0|2,0,0]=3 414 B8R1.2 CNC1CCCNC1 MCULE-8798931831 [1,0,0,0,0,0|2,0,0]=3 415 B8R1.2 CNC1CCCOC1 MCULE-5347484719 [1,0,0,0,0,0|3,0,0]=4 416 B8R1.2 CNC1CCCOC1 MCULE-9684329786 [1,0,0,0,0,0|3,0,0]=4 417 B8R1.2 CNC1CCCSC1 MCULE-1133400404 [1,0,0,0,0,0|3,0,0]=4 418 B8R1.2 CNC1CCCSC1 MCULE-7973096065 [1,0,0,0,0,0|3,0,0]=4 419 B8R1.2 CN[C@@H]1CCCOC1 MCULE-4540841602 [1,0,0,0,0,0|3,0,0]=4 420 B8R1.2 CN[C@@H]1CCCOC1 MCULE-6421899072 [1,0,0,0,0,0|3,0,0]=4 421 B8R1.2 CN[C@H]1CCCNC1 MCULE-5028194287 [1,0,0,0,0,0|2,0,0]=3 422 B8R1.2 CN[C@H]1CCCNC1 MCULE-5432117284 [1,0,0,0,0,0|2,0,0]=3 423 B8R1.2 CN[C@H]1CCCNC1 MCULE-8038385178 [1,0,0,0,0,0|2,0,0]=3 424 B8R1.2 CN[C@H]1CCCOC1 MCULE-2085945812 [1,0,0,0,0,0|3,0,0]=4 425 B8R1.2 CN[C@H]1CCCOC1 MCULE-3537766000 [1,0,0,0,0,0|3,0,0]=4 426 B8R1.2 COC1CCCCC1 MCULE-2340244681 [1,0,0,0,0,0|3,0,0]=4 427 B8R1.2 COC1CCCNC1 MCULE-2428257033 [1,0,0,0,0,0|2,0,0]=3 428 B8R1.2 COC1CCCNC1 MCULE-8656248481 [1,0,0,0,0,0|2,0,0]=3 429 B8R1.2 COC1CNCCO1 MCULE-4273991787 [1,0,0,0,0,0|3,0,0]=4 430 B8R1.2 CO[C@@H]1CCCNC1 MCULE-1593626348 [1,0,0,0,0,0|2,0,0]=3 431 B8R1.2 CO[C@@H]1CCCNC1 MCULE-4085125909 [1,0,0,0,0,0|2,0,0]=3 432 B8R1.2 CO[C@@H]1CCCNC1 MCULE-6313387662 [1,0,0,0,0,0|2,0,0]=3 433 B8R1.2 CO[C@@H]1CCCNC1 MCULE-8494307603 [1,0,0,0,0,0|2,0,0]=3 434 B8R1.2 CO[C@H]1CCCNC1 MCULE-1042411558 [1,0,0,0,0,0|2,0,0]=3 435 B8R1.2 CO[C@H]1CCCNC1 MCULE-3363706345 [1,0,0,0,0,0|2,0,0]=3 436 B8R1.2 CO[C@H]1CCCNC1 MCULE-3745051847 [1,0,0,0,0,0|2,0,0]=3 437 B8R1.2 CO[C@H]1CCCNC1 MCULE-6475889306 [1,0,0,0,0,0|2,0,0]=3 438 B8R1.2 CSC1CCCCC1 MCULE-5570458252 [1,0,0,0,0,0|3,0,0]=4 439 B8R1.2 CSC1CCCNC1 MCULE-3462764875 [1,0,0,0,0,0|2,0,0]=3 440 B8R1.2 CSC1CCCNC1 MCULE-6182151720 [1,0,0,0,0,0|2,0,0]=3 441 B8R1.2 ClCC1CCCCC1 MCULE-2364408988 [1,0,0,0,0,0|2,0,1]=4 442 B8R1.2 ClCC1CCCNC1 MCULE-5655173642 [1,0,0,0,0,0|1,0,1]=3 443 B8R1.2 ClCC1CCCNC1 MCULE-6782147187 [1,0,0,0,0,0|1,0,1]=3 444 B8R1.2 ClCC1CCCOC1 MCULE-8502008950 [1,0,0,0,0,0|2,0,1]=4 445 B8R1.2 ClCC1CNCCO1 MCULE-6977459966 [1,0,0,0,0,0|2,0,1]=4 446 B8R1.2 ClCC1CNCCO1 MCULE-7633503523 [1,0,0,0,0,0|2,0,1]=4 447 B8R1.2 ClC[C@@H]1CNCCO1 MCULE-8134652552 [1,0,0,0,0,0|2,0,1]=4 448 B8R1.2 ClC[C@H]1CNCCO1 MCULE-4491372571 [1,0,0,0,0,0|2,0,1]=4 449 B8R1.2 FCC1CCCNC1 MCULE-4910890691 [1,0,0,0,0,0|1,0,1]=3 450 B8R1.2 FCC1CCCNC1 MCULE-9227191637 [1,0,0,0,0,0|1,0,1]=3 451 B8R1.2 FCC1CNCCN1 MCULE-3651726090 [1,0,0,0,0,0|2,0,1]=4 452 B8R1.2 FCC1CNCCN1 MCULE-9330203611 [1,0,0,0,0,0|2,0,1]=4 453 B8R1.2 FCC1CNCCO1 MCULE-1442465580 [1,0,0,0,0,0|2,0,1]=4 454 B8R1.2 FCC1CNCCO1 MCULE-9755393279 [1,0,0,0,0,0|2,0,1]=4 455 B8R1.2 FC[C@H]1CNCCN1 MCULE-7261068132 [1,0,0,0,0,0|2,0,1]=4 456 B8R1.2 FC[C@H]1CNCCN1 MCULE-9335969220 [1,0,0,0,0,0|2,0,1]=4 457 B8R1.2 IC=C1CCCCC1 MCULE-9165742833 [1,0,0,0,0,0|2,0,1]=4 458 B8R1.2 ICC1CCCCC1 MCULE-7820192716 [1,0,0,0,0,0|2,0,1]=4 459 B8R1.2 ICC1CCCNC1 MCULE-6140804596 [1,0,0,0,0,0|1,0,1]=3 460 B8R1.2 ICC1CCCNC1 MCULE-7111371001 [1,0,0,0,0,0|1,0,1]=3 461 B8R1.2 ICC1CCCOC1 MCULE-7706519514 [1,0,0,0,0,0|2,0,1]=4 462 B8R1.2 N#CC1CCCCC1 MCULE-2156159345 [1,0,0,0,0,0|2,0,1]=4 463 B8R1.2 N#CC1CCCNC1 MCULE-1330142499 [1,0,0,0,0,0|1,0,1]=3 464 B8R1.2 N#CC1CCCNC1 MCULE-3633865726 [1,0,0,0,0,0|1,0,1]=3 465 B8R1.2 N#CC1CCCNC1 MCULE-5925149452 [1,0,0,0,0,0|1,0,1]=3 466 B8R1.2 N#CC1CCCOC1 MCULE-2931796321 [1,0,0,0,0,0|2,0,1]=4 467 B8R1.2 N#CC1CNCCN1 MCULE-1188170766 [1,0,0,0,0,0|2,0,1]=4 468 B8R1.2 N#CC1CNCCN1 MCULE-4775928488 [1,0,0,0,0,0|2,0,1]=4 469 B8R1.2 N#CC1CNCCN1 MCULE-6191368330 [1,0,0,0,0,0|2,0,1]=4 470 B8R1.2 N#CC1CNCCO1 MCULE-4550543456 [1,0,0,0,0,0|2,0,1]=4 471 B8R1.2 N#CC1CNCCO1 MCULE-6560196862 [1,0,0,0,0,0|2,0,1]=4 472 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-1364055768 [1,0,0,0,0,0|1,0,1]=3 473 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-3422590356 [1,0,0,0,0,0|1,0,1]=3 474 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-3766135168 [1,0,0,0,0,0|1,0,1]=3 475 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-5778643850 [1,0,0,0,0,0|1,0,1]=3 476 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-6164791583 [1,0,0,0,0,0|1,0,1]=3 477 B8R1.2 N#C[C@@H]1CCCNC1 MCULE-7171735860 [1,0,0,0,0,0|1,0,1]=3 478 B8R1.2 N#C[C@@H]1CNCCN1 MCULE-9028983796 [1,0,0,0,0,0|2,0,1]=4 479 B8R1.2 N#C[C@@H]1CNCCO1 MCULE-1210885105 [1,0,0,0,0,0|2,0,1]=4 480 B8R1.2 N#C[C@@H]1CNCCO1 MCULE-1702118123 [1,0,0,0,0,0|2,0,1]=4 481 B8R1.2 N#C[C@H]1CCCNC1 MCULE-4676068376 [1,0,0,0,0,0|1,0,1]=3 482 B8R1.2 N#C[C@H]1CCCNC1 MCULE-7483495478 [1,0,0,0,0,0|1,0,1]=3 483 B8R1.2 N#C[C@H]1CCCNC1 MCULE-8961986217 [1,0,0,0,0,0|1,0,1]=3 484 B8R1.2 N#C[C@H]1CCCNC1 MCULE-9399922029 [1,0,0,0,0,0|1,0,1]=3 485 B8R1.2 N#C[C@H]1CNCCN1 MCULE-1281344864 [1,0,0,0,0,0|2,0,1]=4 486 B8R1.2 N#C[C@H]1CNCCN1 MCULE-4746120491 [1,0,0,0,0,0|2,0,1]=4 487 B8R1.2 N#C[C@H]1CNCCN1 MCULE-5928210075 [1,0,0,0,0,0|2,0,1]=4 488 B8R1.2 N#C[C@H]1CNCCO1 MCULE-7284312056 [1,0,0,0,0,0|2,0,1]=4 489 B8R1.2 N#C[C@H]1CNCCO1 MCULE-7835414987 [1,0,0,0,0,0|2,0,1]=4 490 B8R1.2 N#C[C@H]1CNCCO1 MCULE-8434238785 [1,0,0,0,0,0|2,0,1]=4 491 B8R1.2 N#C[C@H]1CNCCO1 MCULE-9489364726 [1,0,0,0,0,0|2,0,1]=4 492 B8R1.2 NCC1CCCCC1 MCULE-3156148976 [1,0,0,0,0,0|2,0,1]=4 493 B8R1.2 NCC1CCCCC1 MCULE-7375566253 [1,0,0,0,0,0|2,0,1]=4 494 B8R1.2 NCC1CCCCC1 MCULE-8029432210 [1,0,0,0,0,0|2,0,1]=4 495 B8R1.2 NCC1CCCNC1 MCULE-3758525803 [1,0,0,0,0,0|1,0,1]=3 496 B8R1.2 NCC1CCCNC1 MCULE-4215149964 [1,0,0,0,0,0|1,0,1]=3 497 B8R1.2 NCC1CCCOC1 MCULE-2859652493 [1,0,0,0,0,0|2,0,1]=4 498 B8R1.2 NCC1CCCOC1 MCULE-5411442728 [1,0,0,0,0,0|2,0,1]=4 499 B8R1.2 NCC1CCCOC1 MCULE-6616131288 [1,0,0,0,0,0|2,0,1]=4 500 B8R1.2 NCC1CCCOC1 MCULE-9893994601 [1,0,0,0,0,0|2,0,1]=4 501 B8R1.2 NCC1CCCSC1 MCULE-1894328803 [1,0,0,0,0,0|2,0,1]=4 502 B8R1.2 NCC1CNCCO1 MCULE-4362254656 [1,0,0,0,0,0|2,0,1]=4 503 B8R1.2 NCC1CNCCO1 MCULE-9062864656 [1,0,0,0,0,0|2,0,1]=4 504 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4700132151 [1,0,0,0,0,0|1,0,1]=3 505 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4826798446 [1,0,0,0,0,0|1,0,1]=3 506 B8R1.2 NC[C@@H]1CCCNC1 MCULE-5621058783 [1,0,0,0,0,0|1,0,1]=3 507 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5314997557 [1,0,0,0,0,0|2,0,1]=4 508 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5553412637 [1,0,0,0,0,0|2,0,1]=4 509 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6349833867 [1,0,0,0,0,0|2,0,1]=4 510 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6463109886 [1,0,0,0,0,0|2,0,1]=4 511 B8R1.2 NC[C@H]1CCCNC1 MCULE-1544884485 [1,0,0,0,0,0|1,0,1]=3 512 B8R1.2 NC[C@H]1CCCNC1 MCULE-1869159747 [1,0,0,0,0,0|1,0,1]=3 513 B8R1.2 NC[C@H]1CCCNC1 MCULE-5445972707 [1,0,0,0,0,0|1,0,1]=3 514 B8R1.2 NC[C@H]1CCCNC1 MCULE-5734934526 [1,0,0,0,0,0|1,0,1]=3 515 B8R1.2 NC[C@H]1CCCNC1 MCULE-9259563350 [1,0,0,0,0,0|1,0,1]=3 516 B8R1.2 NC[C@H]1CCCOC1 MCULE-1996808023 [1,0,0,0,0,0|2,0,1]=4 517 B8R1.2 NC[C@H]1CCCOC1 MCULE-8044635428 [1,0,0,0,0,0|2,0,1]=4 518 B8R1.2 NC[C@H]1CCCOC1 MCULE-8246511133 [1,0,0,0,0,0|2,0,1]=4 519 B8R1.2 NC[C@H]1CCCOC1 MCULE-8378816563 [1,0,0,0,0,0|2,0,1]=4 520 B8R1.2 NNC1CCCCC1 MCULE-1043288751 [1,0,0,0,0,0|3,0,0]=4 521 B8R1.2 NNC1CCCCC1 MCULE-2654277681 [1,0,0,0,0,0|3,0,0]=4 522 B8R1.2 NNC1CCCCC1 MCULE-3543475794 [1,0,0,0,0,0|3,0,0]=4 523 B8R1.2 NNC1CCCNC1 MCULE-1142369911 [1,0,0,0,0,0|2,0,0]=3 524 B8R1.2 NNC1CCCNC1 MCULE-2208379430 [1,0,0,0,0,0|2,0,0]=3 525 B8R1.2 NNC1CCCNC1 MCULE-2744143558 [1,0,0,0,0,0|2,0,0]=3 526 B8R1.2 NNC1CCCOC1 MCULE-3363963508 [1,0,0,0,0,0|3,0,0]=4 527 B8R1.2 NNC1CCCOC1 MCULE-4328194619 [1,0,0,0,0,0|3,0,0]=4 528 B8R1.2 NNC1CCCOC1 MCULE-6284470956 [1,0,0,0,0,0|3,0,0]=4 529 B8R1.2 NNC1CCCSC1 MCULE-2745263925 [1,0,0,0,0,0|3,0,0]=4 530 B8R1.2 NNC1CCCSC1 MCULE-3788828042 [1,0,0,0,0,0|3,0,0]=4 531 B8R1.2 NN[C@H]1CCCOC1 MCULE-1777058599 [1,0,0,0,0,0|3,0,0]=4 532 B8R1.2 NN[C@H]1CCCOC1 MCULE-4593180841 [1,0,0,0,0,0|3,0,0]=4 533 B8R1.2 NOC1CCCCC1 MCULE-1475995970 [1,0,0,0,0,0|3,0,0]=4 534 B8R1.2 NOC1CCCCC1 MCULE-3638462708 [1,0,0,0,0,0|3,0,0]=4 535 B8R1.2 NOC1CCCNC1 MCULE-5903081349 [1,0,0,0,0,0|2,0,0]=3 536 B8R1.2 NOC1CCCNC1 MCULE-9939729891 [1,0,0,0,0,0|2,0,0]=3 537 B8R1.2 O=CC1=CCCCC1 MCULE-6209420256 [1,0,0,0,0,0|1,0,2]=4 538 B8R1.2 O=CC1=CCCOC1 MCULE-5495935874 [1,0,0,0,0,0|1,0,2]=4 539 B8R1.2 O=CC1=CCCSC1 MCULE-9611960845 [1,0,0,0,0,0|1,0,2]=4 540 B8R1.2 O=CC1=COCCC1 MCULE-5246467858 [1,0,0,0,0,0|1,0,2]=4 541 B8R1.2 O=CC1C=CCCC1 MCULE-7360804121 [1,0,0,0,0,0|1,0,1]=3 542 B8R1.2 O=CC1CC=CCC1 MCULE-4752119585 [1,0,0,0,0,0|1,0,1]=3 543 B8R1.2 O=CC1CCC=CO1 MCULE-1271711654 [1,0,0,0,0,0|2,0,1]=4 544 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [1,0,0,0,0,0|1,0,0]=2 545 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [1,0,0,0,0,0|2,0,0]=3 546 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [1,0,0,0,0,0|2,0,0]=3 547 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [1,0,0,0,0,0|2,0,0]=3 548 B8R1.2 O=CC1CCCNC1 MCULE-4037480911 [1,0,0,0,0,0|0,0,0]=1 549 B8R1.2 O=CC1CCCNC1 MCULE-9205787069 [1,0,0,0,0,0|0,0,0]=1 550 B8R1.2 O=CC1CCCOC1 MCULE-6841728518 [1,0,0,0,0,0|1,0,0]=2 551 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [1,0,0,0,0,0|1,0,0]=2 552 B8R1.2 O=CC1CCNCC1 MCULE-3856245073 [1,0,0,0,0,0|2,0,0]=3 553 B8R1.2 O=CC1CCNCC1 MCULE-8439609130 [1,0,0,0,0,0|2,0,0]=3 554 B8R1.2 O=CC1CCOCC1 MCULE-6884786677 [1,0,0,0,0,0|2,0,0]=3 555 B8R1.2 O=CC1CCSCC1 MCULE-4728594373 [1,0,0,0,0,0|2,0,0]=3 556 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [1,0,0,0,0,0|2,0,0]=3 557 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [1,0,0,0,0,0|2,0,0]=3 558 B8R1.2 O=CN1CCNCC1 MCULE-8359044100 [1,0,0,0,0,0|3,0,0]=4 559 B8R1.2 O=CN1CCOCC1 MCULE-2465964585 [1,0,0,0,0,0|3,0,0]=4 560 B8R1.2 O=C[C@@H]1CCC=CO1 MCULE-1864295712 [1,0,0,0,0,0|2,0,1]=4 561 B8R1.2 O=NN1CCCCC1 MCULE-6180064865 [1,0,0,0,0,0|3,0,0]=4 562 B8R1.2 OCC1C=CCCC1 MCULE-3264381346 [1,0,0,0,0,0|1,0,2]=4 563 B8R1.2 OCC1CC=CCC1 MCULE-7843809650 [1,0,0,0,0,0|1,0,2]=4 564 B8R1.2 OCC1CCCCC1 MCULE-6571547092 [1,0,0,0,0,0|1,0,1]=3 565 B8R1.2 OCC1CCCCN1 MCULE-1839660028 [1,0,0,0,0,0|2,0,1]=4 566 B8R1.2 OCC1CCCCN1 MCULE-5190999833 [1,0,0,0,0,0|2,0,1]=4 567 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [1,0,0,0,0,0|2,0,1]=4 568 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [1,0,0,0,0,0|2,0,1]=4 569 B8R1.2 OCC1CCCCS1 MCULE-8533707311 [1,0,0,0,0,0|2,0,1]=4 570 B8R1.2 OCC1CCCNC1 MCULE-1126180349 [1,0,0,0,0,0|0,0,1]=2 571 B8R1.2 OCC1CCCNC1 MCULE-1796388857 [1,0,0,0,0,0|0,0,1]=2 572 B8R1.2 OCC1CCCNC1 MCULE-3885962581 [1,0,0,0,0,0|0,0,1]=2 573 B8R1.2 OCC1CCCNC1 MCULE-9246039906 [1,0,0,0,0,0|0,0,1]=2 574 B8R1.2 OCC1CCCOC1 MCULE-6464024960 [1,0,0,0,0,0|1,0,1]=3 575 B8R1.2 OCC1CCCOC1 MCULE-9624599290 [1,0,0,0,0,0|1,0,1]=3 576 B8R1.2 OCC1CCCSC1 MCULE-1730158244 [1,0,0,0,0,0|1,0,1]=3 577 B8R1.2 OCC1CCNCC1 MCULE-3303736479 [1,0,0,0,0,0|2,0,1]=4 578 B8R1.2 OCC1CCNCC1 MCULE-5679503328 [1,0,0,0,0,0|2,0,1]=4 579 B8R1.2 OCC1CCOCC1 MCULE-8259124266 [1,0,0,0,0,0|2,0,1]=4 580 B8R1.2 OCC1CCSCC1 MCULE-5223983457 [1,0,0,0,0,0|2,0,1]=4 581 B8R1.2 OCC1CNCCN1 MCULE-1401587868 [1,0,0,0,0,0|1,0,1]=3 582 B8R1.2 OCC1CNCCN1 MCULE-7423856879 [1,0,0,0,0,0|1,0,1]=3 583 B8R1.2 OCC1CNCCN1 MCULE-8309538868 [1,0,0,0,0,0|1,0,1]=3 584 B8R1.2 OCC1CNCCN1 MCULE-9359285661 [1,0,0,0,0,0|1,0,1]=3 585 B8R1.2 OCC1CNCCO1 MCULE-1938288280 [1,0,0,0,0,0|1,0,1]=3 586 B8R1.2 OCC1CNCCO1 MCULE-7041892647 [1,0,0,0,0,0|1,0,1]=3 587 B8R1.2 OCC1CNCCO1 MCULE-8873542150 [1,0,0,0,0,0|1,0,1]=3 588 B8R1.2 OCC1CNCCO1 MCULE-9279337391 [1,0,0,0,0,0|1,0,1]=3 589 B8R1.2 OCC1COCCN1 MCULE-1141875416 [1,0,0,0,0,0|2,0,1]=4 590 B8R1.2 OCC1COCCN1 MCULE-2383049328 [1,0,0,0,0,0|2,0,1]=4 591 B8R1.2 OCC1COCCN1 MCULE-3747324792 [1,0,0,0,0,0|2,0,1]=4 592 B8R1.2 OCC1COCCN1 MCULE-8656197859 [1,0,0,0,0,0|2,0,1]=4 593 B8R1.2 OCC1COCCO1 MCULE-3788845525 [1,0,0,0,0,0|2,0,1]=4 594 B8R1.2 OCC1COCCO1 MCULE-5558091087 [1,0,0,0,0,0|2,0,1]=4 595 B8R1.2 OCC1CSCCN1 MCULE-9615907863 [1,0,0,0,0,0|2,0,1]=4 596 B8R1.2 OC[C@@H]1CCCCN1 MCULE-6170192975 [1,0,0,0,0,0|2,0,1]=4 597 B8R1.2 OC[C@@H]1CCCCN1 MCULE-7805438267 [1,0,0,0,0,0|2,0,1]=4 598 B8R1.2 OC[C@@H]1CCCCN1 MCULE-8160671578 [1,0,0,0,0,0|2,0,1]=4 599 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [1,0,0,0,0,0|2,0,1]=4 600 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [1,0,0,0,0,0|2,0,1]=4 601 B8R1.2 OC[C@@H]1CCCNC1 MCULE-1362591489 [1,0,0,0,0,0|0,0,1]=2 602 B8R1.2 OC[C@@H]1CCCNC1 MCULE-2943211570 [1,0,0,0,0,0|0,0,1]=2 603 B8R1.2 OC[C@@H]1CCCNC1 MCULE-8452110091 [1,0,0,0,0,0|0,0,1]=2 604 B8R1.2 OC[C@@H]1CCCNC1 MCULE-9511978382 [1,0,0,0,0,0|0,0,1]=2 605 B8R1.2 OC[C@@H]1CCCOC1 MCULE-5580637299 [1,0,0,0,0,0|1,0,1]=3 606 B8R1.2 OC[C@@H]1CCCOC1 MCULE-9673827278 [1,0,0,0,0,0|1,0,1]=3 607 B8R1.2 OC[C@@H]1CNCCN1 MCULE-3656110325 [1,0,0,0,0,0|1,0,1]=3 608 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7030471384 [1,0,0,0,0,0|1,0,1]=3 609 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7465480170 [1,0,0,0,0,0|1,0,1]=3 610 B8R1.2 OC[C@@H]1CNCCN1 MCULE-9542102138 [1,0,0,0,0,0|1,0,1]=3 611 B8R1.2 OC[C@@H]1CNCCO1 MCULE-5428209505 [1,0,0,0,0,0|1,0,1]=3 612 B8R1.2 OC[C@@H]1CNCCO1 MCULE-6006812099 [1,0,0,0,0,0|1,0,1]=3 613 B8R1.2 OC[C@@H]1CNCCO1 MCULE-6118730357 [1,0,0,0,0,0|1,0,1]=3 614 B8R1.2 OC[C@@H]1CNCCO1 MCULE-9753568594 [1,0,0,0,0,0|1,0,1]=3 615 B8R1.2 OC[C@@H]1COCCN1 MCULE-2260461335 [1,0,0,0,0,0|2,0,1]=4 616 B8R1.2 OC[C@@H]1COCCN1 MCULE-7365178843 [1,0,0,0,0,0|2,0,1]=4 617 B8R1.2 OC[C@@H]1COCCN1 MCULE-8155625467 [1,0,0,0,0,0|2,0,1]=4 618 B8R1.2 OC[C@@H]1COCCN1 MCULE-9822056975 [1,0,0,0,0,0|2,0,1]=4 619 B8R1.2 OC[C@@H]1COCCO1 MCULE-5847134890 [1,0,0,0,0,0|2,0,1]=4 620 B8R1.2 OC[C@@H]1COCCO1 MCULE-6096501847 [1,0,0,0,0,0|2,0,1]=4 621 B8R1.2 OC[C@H]1CCCCN1 MCULE-1585224164 [1,0,0,0,0,0|2,0,1]=4 622 B8R1.2 OC[C@H]1CCCCN1 MCULE-2860177964 [1,0,0,0,0,0|2,0,1]=4 623 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [1,0,0,0,0,0|2,0,1]=4 624 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [1,0,0,0,0,0|2,0,1]=4 625 B8R1.2 OC[C@H]1CCCNC1 MCULE-3504380705 [1,0,0,0,0,0|0,0,1]=2 626 B8R1.2 OC[C@H]1CCCNC1 MCULE-6518143765 [1,0,0,0,0,0|0,0,1]=2 627 B8R1.2 OC[C@H]1CCCNC1 MCULE-6752674060 [1,0,0,0,0,0|0,0,1]=2 628 B8R1.2 OC[C@H]1CCCNC1 MCULE-9392193352 [1,0,0,0,0,0|0,0,1]=2 629 B8R1.2 OC[C@H]1CCCOC1 MCULE-8066618329 [1,0,0,0,0,0|1,0,1]=3 630 B8R1.2 OC[C@H]1CCCOC1 MCULE-8831105119 [1,0,0,0,0,0|1,0,1]=3 631 B8R1.2 OC[C@H]1CNCCN1 MCULE-2062612556 [1,0,0,0,0,0|1,0,1]=3 632 B8R1.2 OC[C@H]1CNCCN1 MCULE-3003505442 [1,0,0,0,0,0|1,0,1]=3 633 B8R1.2 OC[C@H]1CNCCN1 MCULE-3400481255 [1,0,0,0,0,0|1,0,1]=3 634 B8R1.2 OC[C@H]1CNCCN1 MCULE-5683382374 [1,0,0,0,0,0|1,0,1]=3 635 B8R1.2 OC[C@H]1CNCCN1 MCULE-8795905011 [1,0,0,0,0,0|1,0,1]=3 636 B8R1.2 OC[C@H]1CNCCO1 MCULE-2083087681 [1,0,0,0,0,0|1,0,1]=3 637 B8R1.2 OC[C@H]1CNCCO1 MCULE-2399844881 [1,0,0,0,0,0|1,0,1]=3 638 B8R1.2 OC[C@H]1CNCCO1 MCULE-5372536833 [1,0,0,0,0,0|1,0,1]=3 639 B8R1.2 OC[C@H]1CNCCO1 MCULE-9994722027 [1,0,0,0,0,0|1,0,1]=3 640 B8R1.2 OC[C@H]1COCCN1 MCULE-2570187475 [1,0,0,0,0,0|2,0,1]=4 641 B8R1.2 OC[C@H]1COCCN1 MCULE-5479794518 [1,0,0,0,0,0|2,0,1]=4 642 B8R1.2 OC[C@H]1COCCN1 MCULE-5550353523 [1,0,0,0,0,0|2,0,1]=4 643 B8R1.2 OC[C@H]1COCCN1 MCULE-6091772249 [1,0,0,0,0,0|2,0,1]=4 644 B8R1.2 OC[C@H]1COCCO1 MCULE-1373070349 [1,0,0,0,0,0|2,0,1]=4 645 B8R1.2 OC[C@H]1COCCO1 MCULE-9271539014 [1,0,0,0,0,0|2,0,1]=4 646 B8R1.2 ON=C1CCCCC1 MCULE-4628080057 [1,0,0,0,0,0|2,0,1]=4 647 B8R1.2 ONC1CCCCC1 MCULE-7854482550 [1,0,0,0,0,0|2,0,0]=3 648 B8R1.2 O[NH2+]C1CCCCC1 MCULE-5578731568 [1,0,0,0,0,0|2,0,0]=3 649 B8R1.2 S=CN1CCCCC1 MCULE-9360358622 [1,0,0,0,0,0|2,1,0]=4 650 B8R1.2 SCC1CCCCC1 MCULE-4073711524 [1,0,0,0,0,0|1,1,1]=4 651 B8R1.2 SCC1CCCOC1 MCULE-1197721149 [1,0,0,0,0,0|1,1,1]=4 652 B10R1.13 C=C1CCC(CC1)C(=O)O MCULE-9520777832 [0,1,0,0,0,0|1,0,1]=3 653 B10R1.13 CC(=O)C1CC=C(CC1)Br MCULE-8615852716 [0,1,0,0,0,0|2,0,1]=4 654 B10R1.13 CC(=O)C1CC=C(CC1)C MCULE-3149377803 [0,1,0,0,0,0|2,0,1]=4 655 B10R1.13 CC(=O)C1CCC(CC1)C MCULE-6102529388 [0,1,0,0,0,0|2,0,0]=3 656 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-1009720315 [0,1,0,0,0,0|2,0,0]=3 657 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-5617448654 [0,1,0,0,0,0|2,0,0]=3 658 B10R1.13 CC(=O)C1CCC(CC1)O MCULE-8384212790 [0,1,0,0,0,0|2,0,0]=3 659 B10R1.13 CC(=O)C1CCN(CC1)C MCULE-8004082884 [0,1,0,0,0,0|3,0,0]=4 660 B10R1.13 CC(=O)N1CCC(CC1)Br MCULE-7581602454 [0,1,0,0,0,0|3,0,0]=4 661 B10R1.13 CC(=O)N1CCC(CC1)C MCULE-9452710468 [0,1,0,0,0,0|3,0,0]=4 662 B10R1.13 CC(=O)N1CCC(CC1)Cl MCULE-5276244903 [0,1,0,0,0,0|3,0,0]=4 663 B10R1.13 CC(=O)N1CCC(CC1)I MCULE-1480854820 [0,1,0,0,0,0|3,0,0]=4 664 B10R1.13 CC(=O)N1CCC(CC1)N MCULE-3741121628 [0,1,0,0,0,0|3,0,0]=4 665 B10R1.13 CC(=O)N1CCC(CC1)N MCULE-5857549421 [0,1,0,0,0,0|3,0,0]=4 666 B10R1.13 CC(=O)N1CCC(CC1)N MCULE-6409788828 [0,1,0,0,0,0|3,0,0]=4 667 B10R1.13 CC(=O)N1CCC(CC1)O MCULE-8657432815 [0,1,0,0,0,0|3,0,0]=4 668 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C MCULE-1016150505 [0,1,0,0,0,0|2,0,0]=3 669 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-6674769937 [0,1,0,0,0,0|2,0,0]=3 670 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-7289775544 [0,1,0,0,0,0|2,0,0]=3 671 B10R1.13 CC1=CCC(CC1)C(=O)O MCULE-8997751425 [0,1,0,0,0,0|1,0,1]=3 672 B10R1.13 CC1=CCC(CN1)C(=O)O MCULE-6736360947 [0,1,0,0,0,0|0,0,2]=3 673 B10R1.13 CC1CC=C(CC1)C(=O)O MCULE-7341526311 [0,1,0,0,0,0|1,0,2]=4 674 B10R1.13 CC1CCC(CC1)C(=O)Cl MCULE-4812590612 [0,1,0,0,0,0|2,0,0]=3 675 B10R1.13 CC1CCC(CC1)C(=O)O MCULE-3225182334 [0,1,0,0,0,0|1,0,0]=2 676 B10R1.13 CC1CCC(CN1)C(=O)N MCULE-7780455991 [0,1,0,0,0,0|1,0,0]=2 677 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-3840727873 [0,1,0,0,0,0|0,0,0]=1 678 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-5946890830 [0,1,0,0,0,0|0,0,0]=1 679 B10R1.13 CC1CCC(CN1)C(C)C MCULE-4518562235 [0,1,0,0,0,0|2,0,1]=4 680 B10R1.13 CC1CCC(CO1)C(=O)O MCULE-6526905782 [0,1,0,0,0,0|1,0,0]=2 681 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-2912599846 [0,1,0,0,0,0|2,0,0]=3 682 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-3297162881 [0,1,0,0,0,0|2,0,0]=3 683 B10R1.13 CC1CCN(CC1)C(=O)Cl MCULE-7961285873 [0,1,0,0,0,0|3,0,0]=4 684 B10R1.13 CC1COC(CN1)C(=O)O MCULE-7809709557 [0,1,0,0,0,0|1,0,0]=2 685 B10R1.13 CN1CCC(CC1)C(=O)Cl MCULE-5321418776 [0,1,0,0,0,0|3,0,0]=4 686 B10R1.13 CN1CCC(CC1)C(=O)Cl MCULE-7254009533 [0,1,0,0,0,0|3,0,0]=4 687 B10R1.13 CN1CCC(CC1)C(=O)N MCULE-2029707277 [0,1,0,0,0,0|3,0,0]=4 688 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-1330176845 [0,1,0,0,0,0|2,0,0]=3 689 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-2860414660 [0,1,0,0,0,0|2,0,0]=3 690 B10R1.13 CN1CCN(CC1)C(=O)O MCULE-3645740759 [0,1,0,0,0,0|3,0,0]=4 691 B10R1.13 CN1CCN(CC1)C(=O)O MCULE-3916839663 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.13 C[C@@H]1CC[C@@H](CN1)C(=O)O MCULE-8843664488 [0,1,0,0,0,0|0,0,0]=1 693 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2204464981 [0,1,0,0,0,0|0,0,0]=1 694 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2225073323 [0,1,0,0,0,0|0,0,0]=1 695 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-3036379148 [0,1,0,0,0,0|0,0,0]=1 696 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-9649426657 [0,1,0,0,0,0|0,0,0]=1 697 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-8093925660 [0,1,0,0,0,0|2,0,0]=3 698 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-9603514021 [0,1,0,0,0,0|2,0,0]=3 699 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)Cl MCULE-2231388476 [0,1,0,0,0,0|2,0,0]=3 700 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)N MCULE-9668889856 [0,1,0,0,0,0|2,0,0]=3 701 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)O MCULE-3272652270 [0,1,0,0,0,0|1,0,0]=2 702 B10R1.13 C[C@H]1CC[C@@H](CN1)C(=O)O MCULE-6340569413 [0,1,0,0,0,0|0,0,0]=1 703 B10R1.13 C[C@H]1CC[C@H](CC1)C(=O)O MCULE-7434442752 [0,1,0,0,0,0|1,0,0]=2 704 B10R1.13 C[C@H]1CC[C@H](CN1)C(=O)O MCULE-3955685184 [0,1,0,0,0,0|0,0,0]=1 705 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-4706739993 [0,1,0,0,0,0|2,0,0]=3 706 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-9210189761 [0,1,0,0,0,0|2,0,0]=3 707 B10R1.13 NC(=O)C1CCC(=O)CC1 MCULE-8335948190 [0,1,0,0,0,0|2,0,1]=4 708 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4469475065 [0,1,0,0,0,0|2,0,0]=3 709 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4892039405 [0,1,0,0,0,0|2,0,0]=3 710 B10R1.13 NC(=O)C1CCC(CC1)O MCULE-9699134683 [0,1,0,0,0,0|2,0,0]=3 711 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-1702911232 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-9609134356 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.13 NC(=O)N1CCC(CC1)N MCULE-3646405188 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.13 NC(=O)N1CCC(CC1)N MCULE-9726087016 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1123100792 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1890273222 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-3122399272 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-5583780093 [0,1,0,0,0,0|3,0,0]=4 719 B10R1.13 NC(=O)[C@H]1CC[C@@H](CC1)O MCULE-6564995524 [0,1,0,0,0,0|2,0,0]=3 720 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-1727204707 [0,1,0,0,0,0|2,0,0]=3 721 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-4007102653 [0,1,0,0,0,0|2,0,0]=3 722 B10R1.13 NC1=NCC(CN1)C(=O)O MCULE-5846461385 [0,1,0,0,0,0|1,0,1]=3 723 B10R1.13 NC1=NCC(CN1)C(=O)O MCULE-7792293428 [0,1,0,0,0,0|1,0,1]=3 724 B10R1.13 NC1CC=C(CC1)C(=O)O MCULE-8027933659 [0,1,0,0,0,0|1,0,2]=4 725 B10R1.13 NC1CCC(CC1)C(=O)Cl MCULE-4909714198 [0,1,0,0,0,0|2,0,0]=3 726 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-6722954971 [0,1,0,0,0,0|1,0,0]=2 727 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-9273524734 [0,1,0,0,0,0|1,0,0]=2 728 B10R1.13 NC1CCN(CC1)C(=O)F MCULE-6953007245 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.13 NC1CCN(CC1)C(=O)F MCULE-8656170023 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-5282665037 [0,1,0,0,0,0|1,0,0]=2 731 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-8647828626 [0,1,0,0,0,0|1,0,0]=2 732 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-1388612667 [0,1,0,0,0,0|1,0,0]=2 733 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-8724032546 [0,1,0,0,0,0|1,0,0]=2 734 B10R1.13 O=C(Cl)C1CCC(CC1)O MCULE-9104583730 [0,1,0,0,0,0|2,0,0]=3 735 B10R1.13 O=C(O)C1CC=C(CC1)Br MCULE-3957085478 [0,1,0,0,0,0|1,0,1]=3 736 B10R1.13 O=C(O)C1CC=C(CC1)F MCULE-5924974191 [0,1,0,0,0,0|1,0,1]=3 737 B10R1.13 O=C(O)C1CCC(CC1)Br MCULE-4952970959 [0,1,0,0,0,0|1,0,0]=2 738 B10R1.13 O=C(O)C1CCC(CC1)Cl MCULE-9596975674 [0,1,0,0,0,0|1,0,0]=2 739 B10R1.13 O=C(O)C1CCC(CC1)F MCULE-8237318279 [0,1,0,0,0,0|1,0,0]=2 740 B10R1.13 O=C(O)C1CCC(CC1)O MCULE-2480420127 [0,1,0,0,0,0|1,0,0]=2 741 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-3204705068 [0,1,0,0,0,0|2,0,0]=3 742 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-7178398033 [0,1,0,0,0,0|2,0,0]=3 743 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1384355113 [0,1,0,0,0,0|2,0,0]=3 744 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1678351091 [0,1,0,0,0,0|2,0,0]=3 745 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-5287470680 [0,1,0,0,0,0|2,0,0]=3 746 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-7907264464 [0,1,0,0,0,0|2,0,0]=3 747 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-2425882122 [0,1,0,0,0,0|2,0,0]=3 748 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3071319870 [0,1,0,0,0,0|2,0,0]=3 749 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3130571634 [0,1,0,0,0,0|2,0,0]=3 750 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-4156067811 [0,1,0,0,0,0|2,0,0]=3 751 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-6185299507 [0,1,0,0,0,0|2,0,0]=3 752 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-8875046289 [0,1,0,0,0,0|2,0,0]=3 753 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)F MCULE-9036564869 [0,1,0,0,0,0|1,0,0]=2 754 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)O MCULE-6625595981 [0,1,0,0,0,0|1,0,0]=2 755 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-2267551829 [0,1,0,0,0,0|2,0,0]=3 756 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7339394632 [0,1,0,0,0,0|2,0,0]=3 757 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7777420620 [0,1,0,0,0,0|2,0,0]=3 758 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-9629486094 [0,1,0,0,0,0|2,0,0]=3 759 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)F MCULE-1112147502 [0,1,0,0,0,0|1,0,0]=2 760 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)O MCULE-5519058025 [0,1,0,0,0,0|1,0,0]=2 761 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-3991583469 [0,1,0,0,0,0|2,0,0]=3 762 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8329848691 [0,1,0,0,0,0|2,0,0]=3 763 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8730600296 [0,1,0,0,0,0|2,0,0]=3 764 B10R1.13 O=C1CCC(=NN1)C(=O)O MCULE-1818973372 [0,1,0,0,0,0|1,0,2]=4 765 B10R1.13 O=C1CCC(CC1)C(=O)Cl MCULE-9307268152 [0,1,0,0,0,0|2,0,1]=4 766 B10R1.13 O=C1CCC(CC1)C(=O)O MCULE-3268045048 [0,1,0,0,0,0|1,0,1]=3 767 B10R1.13 O=C1CCC(CN1)C(=O)O MCULE-9788917215 [0,1,0,0,0,0|0,0,1]=2 768 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-4067834062 [0,1,0,0,0,0|2,0,1]=4 769 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-8147757527 [0,1,0,0,0,0|2,0,1]=4 770 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-3191286949 [0,1,0,0,0,0|0,0,1]=2 771 B10R1.13 O=C1CC[C@@H](CN1)C(=O)O MCULE-9692186311 [0,1,0,0,0,0|0,0,1]=2 772 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-4350301488 [0,1,0,0,0,0|2,0,1]=4 773 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-6122427477 [0,1,0,0,0,0|2,0,1]=4 774 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-7864506900 [0,1,0,0,0,0|2,0,1]=4 775 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-8690683788 [0,1,0,0,0,0|2,0,1]=4 776 B10R1.13 O=C1CC[C@H](CN1)C(=O)O MCULE-6590332785 [0,1,0,0,0,0|0,0,1]=2 777 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-2845724258 [0,1,0,0,0,0|2,0,1]=4 778 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-4534690891 [0,1,0,0,0,0|2,0,1]=4 779 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-5755683417 [0,1,0,0,0,0|2,0,1]=4 780 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-6015971784 [0,1,0,0,0,0|2,0,1]=4 781 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-1011618274 [0,1,0,0,0,0|1,0,1]=3 782 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-9345081526 [0,1,0,0,0,0|1,0,1]=3 783 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-1270509503 [0,1,0,0,0,0|1,0,1]=3 784 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-5912128916 [0,1,0,0,0,0|1,0,1]=3 785 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-6974754540 [0,1,0,0,0,0|1,0,1]=3 786 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-9137341829 [0,1,0,0,0,0|1,0,1]=3 787 B10R1.13 O=C1CN[C@H](CN1)C(=O)O MCULE-8928326150 [0,1,0,0,0,0|1,0,1]=3 788 B10R1.13 OB(O)C1CCC(CC1)F MCULE-6773384787 [0,1,0,0,0,0|2,0,1]=4 789 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1423621462 [0,1,0,0,0,0|2,0,0]=3 790 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1814136074 [0,1,0,0,0,0|2,0,0]=3 791 B10R1.15 C#CC(O)C1CCCCC1 MCULE-1450923869 [0,1,0,0,0,0|2,0,1]=4 792 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-3306037072 [0,1,0,0,0,0|2,0,0]=3 793 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-9288344897 [0,1,0,0,0,0|2,0,0]=3 794 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-4117287216 [0,1,0,0,0,0|0,0,0]=1 795 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-8091301795 [0,1,0,0,0,0|0,0,0]=1 796 B10R1.15 C1(CNCCN1)C(=O)OC MCULE-2958013355 [0,1,0,0,0,0|1,0,0]=2 797 B10R1.15 C1(CNCCN1)C(=O)OC MCULE-6072954554 [0,1,0,0,0,0|1,0,0]=2 798 B10R1.15 C1(COCCN1)C(=O)OC MCULE-1359060783 [0,1,0,0,0,0|2,0,0]=3 799 B10R1.15 C1(COCCN1)C(=O)OC MCULE-5136187934 [0,1,0,0,0,0|2,0,0]=3 800 B10R1.15 C=C(CO)C1CCNCC1 MCULE-2096772328 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.15 C=CC(=O)C1CCCCC1 MCULE-2668727628 [0,1,0,0,0,0|2,0,0]=3 802 B10R1.15 C=CC(=O)N1CCCCC1 MCULE-4232061367 [0,1,0,0,0,0|3,0,0]=4 803 B10R1.15 C=CC(O)C1CCCCC1 MCULE-4108928861 [0,1,0,0,0,0|2,0,1]=4 804 B10R1.15 CC(=NO)C1CCCCC1 MCULE-1684283685 [0,1,0,0,0,0|2,0,0]=3 805 B10R1.15 CC(C=O)C1CCCCC1 MCULE-8646762788 [0,1,0,0,0,0|2,0,1]=4 806 B10R1.15 CC(CO)C1CCCCC1 MCULE-8690797205 [0,1,0,0,0,0|2,0,1]=4 807 B10R1.15 CCC(=O)C1CCCCC1 MCULE-8203276385 [0,1,0,0,0,0|2,0,0]=3 808 B10R1.15 CCC(=O)C1CCCCN1 MCULE-6703727171 [0,1,0,0,0,0|3,0,0]=4 809 B10R1.15 CCC(=O)C1CCCCN1 MCULE-7018103553 [0,1,0,0,0,0|3,0,0]=4 810 B10R1.15 CCC(=O)C1CCCNC1 MCULE-3629175971 [0,1,0,0,0,0|1,0,0]=2 811 B10R1.15 CCC(=O)C1CCCOC1 MCULE-5033322176 [0,1,0,0,0,0|2,0,0]=3 812 B10R1.15 CCC(=O)C1CCNCC1 MCULE-3461762998 [0,1,0,0,0,0|3,0,0]=4 813 B10R1.15 CCC(=O)C1CCNCC1 MCULE-9712207477 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.15 CCC(=O)C1CCOCC1 MCULE-4852927980 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.15 CCC(=O)N1CCCNC1 MCULE-4333354297 [0,1,0,0,0,0|2,0,0]=3 816 B10R1.15 CCC(O)C1CCCCC1 MCULE-2881249865 [0,1,0,0,0,0|2,0,1]=4 817 B10R1.15 CNC(=O)C1CC=CCC1 MCULE-7109143487 [0,1,0,0,0,0|2,0,1]=4 818 B10R1.15 CNC(=O)C1CCCCC1 MCULE-4980742243 [0,1,0,0,0,0|2,0,0]=3 819 B10R1.15 CNC(=O)C1CCCCN1 MCULE-2059398226 [0,1,0,0,0,0|3,0,0]=4 820 B10R1.15 CNC(=O)C1CCCCN1 MCULE-6797335969 [0,1,0,0,0,0|3,0,0]=4 821 B10R1.15 CNC(=O)C1CCCNC1 MCULE-2978981353 [0,1,0,0,0,0|1,0,0]=2 822 B10R1.15 CNC(=O)C1CCCNC1 MCULE-6838149669 [0,1,0,0,0,0|1,0,0]=2 823 B10R1.15 CNC(=O)C1CCCNC1 MCULE-7320118999 [0,1,0,0,0,0|1,0,0]=2 824 B10R1.15 CNC(=O)C1CCNCC1 MCULE-4891387097 [0,1,0,0,0,0|3,0,0]=4 825 B10R1.15 CNC(=O)C1CCNCC1 MCULE-7627125289 [0,1,0,0,0,0|3,0,0]=4 826 B10R1.15 CNC(=O)C1CCOCC1 MCULE-3532223730 [0,1,0,0,0,0|3,0,0]=4 827 B10R1.15 CNC(=O)C1CNCCO1 MCULE-3207028564 [0,1,0,0,0,0|2,0,0]=3 828 B10R1.15 CNC(=O)C1CNCCO1 MCULE-6268130075 [0,1,0,0,0,0|2,0,0]=3 829 B10R1.15 CNC(=O)C1COCCN1 MCULE-9896951123 [0,1,0,0,0,0|3,0,0]=4 830 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-3578222481 [0,1,0,0,0,0|3,0,0]=4 831 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-5767177119 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.15 CNC(=O)[C@@H]1CCCNC1 MCULE-4458584627 [0,1,0,0,0,0|1,0,0]=2 833 B10R1.15 CNC(=O)[C@@H]1CCCNC1 MCULE-7833506495 [0,1,0,0,0,0|1,0,0]=2 834 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-1484363402 [0,1,0,0,0,0|3,0,0]=4 835 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-2898288746 [0,1,0,0,0,0|3,0,0]=4 836 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-8199763754 [0,1,0,0,0,0|3,0,0]=4 837 B10R1.15 CNC(=O)[C@H]1CCCNC1 MCULE-4306456945 [0,1,0,0,0,0|1,0,0]=2 838 B10R1.15 CNC(=O)[C@H]1CCCNC1 MCULE-6354630655 [0,1,0,0,0,0|1,0,0]=2 839 B10R1.15 CNC(=O)[C@H]1CCCNC1 MCULE-9283058450 [0,1,0,0,0,0|1,0,0]=2 840 B10R1.15 COC(=O)C1=CCCCC1 MCULE-3153400458 [0,1,0,0,0,0|1,0,2]=4 841 B10R1.15 COC(=O)C1=CCCNC1 MCULE-4220762988 [0,1,0,0,0,0|0,0,2]=3 842 B10R1.15 COC(=O)C1=CCCNC1 MCULE-8178236584 [0,1,0,0,0,0|0,0,2]=3 843 B10R1.15 COC(=O)C1=CCCNC1 MCULE-9139351406 [0,1,0,0,0,0|0,0,2]=3 844 B10R1.15 COC(=O)C1=CNCCC1 MCULE-5565494663 [0,1,0,0,0,0|0,0,2]=3 845 B10R1.15 COC(=O)C1=COCCC1 MCULE-2654885308 [0,1,0,0,0,0|1,0,2]=4 846 B10R1.15 COC(=O)C1CC=CCC1 MCULE-8019345323 [0,1,0,0,0,0|1,0,1]=3 847 B10R1.15 COC(=O)C1CC=CCN1 MCULE-5717808763 [0,1,0,0,0,0|2,0,1]=4 848 B10R1.15 COC(=O)C1CCCCC1 MCULE-6850082589 [0,1,0,0,0,0|1,0,0]=2 849 B10R1.15 COC(=O)C1CCCCN1 MCULE-1345527122 [0,1,0,0,0,0|2,0,0]=3 850 B10R1.15 COC(=O)C1CCCCN1 MCULE-3343413800 [0,1,0,0,0,0|2,0,0]=3 851 B10R1.15 COC(=O)C1CCCCO1 MCULE-4699637806 [0,1,0,0,0,0|2,0,0]=3 852 B10R1.15 COC(=O)C1CCCCS1 MCULE-5621167539 [0,1,0,0,0,0|2,0,0]=3 853 B10R1.15 COC(=O)C1CCCNC1 MCULE-5215588899 [0,1,0,0,0,0|0,0,0]=1 854 B10R1.15 COC(=O)C1CCCNC1 MCULE-8977979820 [0,1,0,0,0,0|0,0,0]=1 855 B10R1.15 COC(=O)C1CCCNN1 MCULE-3033001919 [0,1,0,0,0,0|1,0,0]=2 856 B10R1.15 COC(=O)C1CCCNN1 MCULE-3440886963 [0,1,0,0,0,0|1,0,0]=2 857 B10R1.15 COC(=O)C1CCCOC1 MCULE-8852064521 [0,1,0,0,0,0|1,0,0]=2 858 B10R1.15 COC(=O)C1CCNCC1 MCULE-5613020223 [0,1,0,0,0,0|2,0,0]=3 859 B10R1.15 COC(=O)C1CCNCC1 MCULE-9635570834 [0,1,0,0,0,0|2,0,0]=3 860 B10R1.15 COC(=O)C1CCOCC1 MCULE-9277091866 [0,1,0,0,0,0|2,0,0]=3 861 B10R1.15 COC(=O)C1CCSCC1 MCULE-2533530421 [0,1,0,0,0,0|2,0,0]=3 862 B10R1.15 COC(=O)C1CNCCN1 MCULE-5461430924 [0,1,0,0,0,0|1,0,0]=2 863 B10R1.15 COC(=O)C1CNCCN1 MCULE-5985522017 [0,1,0,0,0,0|1,0,0]=2 864 B10R1.15 COC(=O)C1CNCCO1 MCULE-2698329193 [0,1,0,0,0,0|1,0,0]=2 865 B10R1.15 COC(=O)C1CNCCO1 MCULE-4908930366 [0,1,0,0,0,0|1,0,0]=2 866 B10R1.15 COC(=O)C1CNCCO1 MCULE-5645711588 [0,1,0,0,0,0|1,0,0]=2 867 B10R1.15 COC(=O)C1CNCCO1 MCULE-6370167621 [0,1,0,0,0,0|1,0,0]=2 868 B10R1.15 COC(=O)C1CNCCO1 MCULE-8941359764 [0,1,0,0,0,0|1,0,0]=2 869 B10R1.15 COC(=O)C1COCCN1 MCULE-3550093500 [0,1,0,0,0,0|2,0,0]=3 870 B10R1.15 COC(=O)C1COCCN1 MCULE-6551273056 [0,1,0,0,0,0|2,0,0]=3 871 B10R1.15 COC(=O)C1COCCN1 MCULE-6840431140 [0,1,0,0,0,0|2,0,0]=3 872 B10R1.15 COC(=O)C1CSCCN1 MCULE-3631055578 [0,1,0,0,0,0|2,0,0]=3 873 B10R1.15 COC(=O)C1CSCCN1 MCULE-7757706847 [0,1,0,0,0,0|2,0,0]=3 874 B10R1.15 COC(=O)C1SCCCS1 MCULE-8385963909 [0,1,0,0,0,0|3,0,0]=4 875 B10R1.15 COC(=O)N1CCCCC1 MCULE-4843476028 [0,1,0,0,0,0|2,0,0]=3 876 B10R1.15 COC(=O)N1CCCCC1 MCULE-8096578349 [0,1,0,0,0,0|2,0,0]=3 877 B10R1.15 COC(=O)N1CCNCC1 MCULE-1605451144 [0,1,0,0,0,0|3,0,0]=4 878 B10R1.15 COC(=O)N1CCNCC1 MCULE-1876224214 [0,1,0,0,0,0|3,0,0]=4 879 B10R1.15 COC(=O)N1CCOCC1 MCULE-1622827053 [0,1,0,0,0,0|3,0,0]=4 880 B10R1.15 COC(=O)[C@@H]1CC=CCC1 MCULE-5205723165 [0,1,0,0,0,0|1,0,1]=3 881 B10R1.15 COC(=O)[C@@H]1CC=CCC1 MCULE-8305397953 [0,1,0,0,0,0|1,0,1]=3 882 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-4659733955 [0,1,0,0,0,0|2,0,0]=3 883 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-6675153946 [0,1,0,0,0,0|2,0,0]=3 884 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-7164905117 [0,1,0,0,0,0|2,0,0]=3 885 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-8391987811 [0,1,0,0,0,0|2,0,0]=3 886 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-1357072117 [0,1,0,0,0,0|0,0,0]=1 887 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-6685948915 [0,1,0,0,0,0|0,0,0]=1 888 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-7943195603 [0,1,0,0,0,0|0,0,0]=1 889 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-8245028670 [0,1,0,0,0,0|0,0,0]=1 890 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-4492703729 [0,1,0,0,0,0|1,0,0]=2 891 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-4789174904 [0,1,0,0,0,0|1,0,0]=2 892 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-6004868841 [0,1,0,0,0,0|1,0,0]=2 893 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-8447894362 [0,1,0,0,0,0|1,0,0]=2 894 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-8973989363 [0,1,0,0,0,0|1,0,0]=2 895 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-5551273180 [0,1,0,0,0,0|1,0,0]=2 896 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-5976690411 [0,1,0,0,0,0|1,0,0]=2 897 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-7451026930 [0,1,0,0,0,0|1,0,0]=2 898 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-8752855910 [0,1,0,0,0,0|1,0,0]=2 899 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-1095109510 [0,1,0,0,0,0|1,0,0]=2 900 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-4732803083 [0,1,0,0,0,0|1,0,0]=2 901 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-5642785598 [0,1,0,0,0,0|1,0,0]=2 902 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-5749221307 [0,1,0,0,0,0|1,0,0]=2 903 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-5162429786 [0,1,0,0,0,0|2,0,0]=3 904 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-7239532241 [0,1,0,0,0,0|2,0,0]=3 905 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-7684323850 [0,1,0,0,0,0|2,0,0]=3 906 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-8072335300 [0,1,0,0,0,0|2,0,0]=3 907 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-8375175370 [0,1,0,0,0,0|2,0,0]=3 908 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-9876388752 [0,1,0,0,0,0|2,0,0]=3 909 B10R1.15 COC(=O)[C@@H]1CSCCN1 MCULE-2644672819 [0,1,0,0,0,0|2,0,0]=3 910 B10R1.15 COC(=O)[C@@H]1CSCCN1 MCULE-8721567121 [0,1,0,0,0,0|2,0,0]=3 911 B10R1.15 COC(=O)[C@H]1CC=CCC1 MCULE-1381229233 [0,1,0,0,0,0|1,0,1]=3 912 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5042289968 [0,1,0,0,0,0|2,0,0]=3 913 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5552610931 [0,1,0,0,0,0|2,0,0]=3 914 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6096933206 [0,1,0,0,0,0|2,0,0]=3 915 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6748268572 [0,1,0,0,0,0|2,0,0]=3 916 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-1258591863 [0,1,0,0,0,0|0,0,0]=1 917 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-2913297882 [0,1,0,0,0,0|0,0,0]=1 918 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-7994934831 [0,1,0,0,0,0|0,0,0]=1 919 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-9664872744 [0,1,0,0,0,0|0,0,0]=1 920 B10R1.15 COC(=O)[C@H]1CCCOC1 MCULE-3895837022 [0,1,0,0,0,0|1,0,0]=2 921 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-1502399125 [0,1,0,0,0,0|1,0,0]=2 922 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-4305901126 [0,1,0,0,0,0|1,0,0]=2 923 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-4581702554 [0,1,0,0,0,0|1,0,0]=2 924 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-5249386287 [0,1,0,0,0,0|1,0,0]=2 925 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-1713285364 [0,1,0,0,0,0|1,0,0]=2 926 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-2717742188 [0,1,0,0,0,0|1,0,0]=2 927 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-3191998281 [0,1,0,0,0,0|1,0,0]=2 928 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-4522663718 [0,1,0,0,0,0|1,0,0]=2 929 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-2095296947 [0,1,0,0,0,0|2,0,0]=3 930 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-4051082225 [0,1,0,0,0,0|2,0,0]=3 931 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-5485853687 [0,1,0,0,0,0|2,0,0]=3 932 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-8734141342 [0,1,0,0,0,0|2,0,0]=3 933 B10R1.15 COC(=O)[C@H]1CSCCN1 MCULE-6859763829 [0,1,0,0,0,0|2,0,0]=3 934 B10R1.15 COC(=S)N1CCCCC1 MCULE-9617506114 [0,1,0,0,0,0|2,1,0]=4 935 B10R1.15 N#CC(O)C1CCCCC1 MCULE-2814689309 [0,1,0,0,0,0|2,0,1]=4 936 B10R1.15 N/C(=N/O)/C1CCCCC1 MCULE-7400174450 [0,1,0,0,0,0|2,0,0]=3 937 B10R1.15 N/C(=N\O)/C1CCCNC1 MCULE-7748729178 [0,1,0,0,0,0|1,0,0]=2 938 B10R1.15 N/C(=N\O)/C1CCCNC1 MCULE-9028349942 [0,1,0,0,0,0|1,0,0]=2 939 B10R1.15 N/C(=N\O)/C1CCNCC1 MCULE-8372901738 [0,1,0,0,0,0|3,0,0]=4 940 B10R1.15 N/C(=N\O)/C1CCOCC1 MCULE-6781639672 [0,1,0,0,0,0|3,0,0]=4 941 B10R1.15 N=C(NO)N1CCCCC1 MCULE-3117627837 [0,1,0,0,0,0|3,0,0]=4 942 B10R1.15 NC(CO)C1CCCCC1 MCULE-7205591328 [0,1,0,0,0,0|2,0,1]=4 943 B10R1.15 NC(CO)C1CCCCC1 MCULE-7370703075 [0,1,0,0,0,0|2,0,1]=4 944 B10R1.15 NC(CO)C1CCCCC1 MCULE-8745977604 [0,1,0,0,0,0|2,0,1]=4 945 B10R1.15 NC(CO)C1CCCOC1 MCULE-4152145176 [0,1,0,0,0,0|2,0,1]=4 946 B10R1.15 NC(CO)C1CCCOC1 MCULE-7286913939 [0,1,0,0,0,0|2,0,1]=4 947 B10R1.15 NCC(=O)C1CCCCC1 MCULE-5312619543 [0,1,0,0,0,0|2,0,0]=3 948 B10R1.15 NCC(=O)C1CCCCC1 MCULE-8215004471 [0,1,0,0,0,0|2,0,0]=3 949 B10R1.15 NCC(=O)N1CCCCC1 MCULE-6847570430 [0,1,0,0,0,0|3,0,0]=4 950 B10R1.15 NCC(=O)N1CCCCC1 MCULE-7684350460 [0,1,0,0,0,0|3,0,0]=4 951 B10R1.15 NCC(O)C1CCCCC1 MCULE-7199366772 [0,1,0,0,0,0|2,0,1]=4 952 B10R1.15 NCC(O)C1CCCCC1 MCULE-8529609856 [0,1,0,0,0,0|2,0,1]=4 953 B10R1.15 NNC(=O)C1CC=CCC1 MCULE-9824461526 [0,1,0,0,0,0|2,0,1]=4 954 B10R1.15 NNC(=O)C1CCCCC1 MCULE-3486870731 [0,1,0,0,0,0|2,0,0]=3 955 B10R1.15 NNC(=O)C1CCCCO1 MCULE-7036120684 [0,1,0,0,0,0|3,0,0]=4 956 B10R1.15 NNC(=O)C1CCCNC1 MCULE-6747055430 [0,1,0,0,0,0|1,0,0]=2 957 B10R1.15 NNC(=O)C1CCCOC1 MCULE-6809433075 [0,1,0,0,0,0|2,0,0]=3 958 B10R1.15 NNC(=O)C1CCNCC1 MCULE-8248667450 [0,1,0,0,0,0|3,0,0]=4 959 B10R1.15 NNC(=O)C1CCOCC1 MCULE-9421182063 [0,1,0,0,0,0|3,0,0]=4 960 B10R1.15 NNC(=O)C1COCCO1 MCULE-5807277104 [0,1,0,0,0,0|3,0,0]=4 961 B10R1.15 NNC(=O)[C@H]1CCCOC1 MCULE-9808551984 [0,1,0,0,0,0|2,0,0]=3 962 B10R1.15 N[C@@H](CO)C1CCCCC1 MCULE-2384926884 [0,1,0,0,0,0|2,0,1]=4 963 B10R1.15 N[C@@H](CO)C1CCCCC1 MCULE-7290753104 [0,1,0,0,0,0|2,0,1]=4 964 B10R1.15 N[C@@H](CO)C1CCCCC1 MCULE-8304806141 [0,1,0,0,0,0|2,0,1]=4 965 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-2300999389 [0,1,0,0,0,0|2,0,1]=4 966 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-6613082885 [0,1,0,0,0,0|2,0,1]=4 967 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-6887686110 [0,1,0,0,0,0|2,0,1]=4 968 B10R1.15 N[C@H](CO)C1CCCCC1 MCULE-9265008029 [0,1,0,0,0,0|2,0,1]=4 969 B10R1.15 O/N=C(\Cl)/C1CCCCC1 MCULE-3114876572 [0,1,0,0,0,0|2,0,0]=3 970 B10R1.15 O/N=C(\Cl)/C1CCOCC1 MCULE-2836387970 [0,1,0,0,0,0|3,0,0]=4 971 B10R1.15 O=C(CBr)C1CCCCC1 MCULE-1828005520 [0,1,0,0,0,0|2,0,0]=3 972 B10R1.15 O=C(CBr)C1CCCOC1 MCULE-9091642966 [0,1,0,0,0,0|2,0,0]=3 973 B10R1.15 O=C(CBr)C1CCOCC1 MCULE-2334595244 [0,1,0,0,0,0|3,0,0]=4 974 B10R1.15 O=C(CBr)N1CCCCC1 MCULE-5864412053 [0,1,0,0,0,0|3,0,0]=4 975 B10R1.15 O=C(CCl)C1CCCCC1 MCULE-1798641564 [0,1,0,0,0,0|2,0,0]=3 976 B10R1.15 O=C(CCl)C1CCCCO1 MCULE-3635601081 [0,1,0,0,0,0|3,0,0]=4 977 B10R1.15 O=C(CCl)C1CCOCC1 MCULE-3211197448 [0,1,0,0,0,0|3,0,0]=4 978 B10R1.15 O=C(CCl)N1CCCCC1 MCULE-2403575789 [0,1,0,0,0,0|3,0,0]=4 979 B10R1.15 O=C(CO)C1CCCCC1 MCULE-7711081081 [0,1,0,0,0,0|1,0,0]=2 980 B10R1.15 O=C(CO)N1CCCCC1 MCULE-2972774035 [0,1,0,0,0,0|2,0,0]=3 981 B10R1.15 O=C(CO)N1CCNCC1 MCULE-6053259606 [0,1,0,0,0,0|3,0,0]=4 982 B10R1.15 O=C(CO)N1CCOCC1 MCULE-9777246982 [0,1,0,0,0,0|3,0,0]=4 983 B10R1.15 O=C(NO)C1CCCCC1 MCULE-4311817351 [0,1,0,0,0,0|1,0,0]=2 984 B10R1.15 O=C(NO)C1CCNCC1 MCULE-3667251310 [0,1,0,0,0,0|2,0,0]=3 985 B10R1.15 OC(CBr)C1CCCCC1 MCULE-4672715356 [0,1,0,0,0,0|2,0,1]=4 986 B10R1.15 OC(CCl)C1CCCCC1 MCULE-2813494650 [0,1,0,0,0,0|2,0,1]=4 987 B10R1.15 OC(CF)C1CCCCC1 MCULE-2558300635 [0,1,0,0,0,0|2,0,1]=4 988 B10R1.15 OC(CI)C1CCCCC1 MCULE-8401899170 [0,1,0,0,0,0|2,0,1]=4 989 B10R1.28 C1(CCCNC1)C(F)(F)F MCULE-9293201031 [0,1,0,0,0,0|2,0,1]=4 990 B10R1.28 CC(C)(C)C1CCCNC1 MCULE-7920088752 [0,1,0,0,0,0|2,0,1]=4 991 B10R1.28 CC(C)(C)C1CCCNC1 MCULE-8329986202 [0,1,0,0,0,0|2,0,1]=4 992 B10R1.28 CC(C)(C)[C@H]1CCCNC1 MCULE-8228457917 [0,1,0,0,0,0|2,0,1]=4 993 B10R1.28 CC(C)(O)C1CCCCC1 MCULE-7936846409 [0,1,0,0,0,0|2,0,1]=4 994 B10R1.28 CC(C)(O)C1CCCNC1 MCULE-3090376923 [0,1,0,0,0,0|1,0,1]=3 995 B10R1.28 CC(C)(O)C1CCCNC1 MCULE-4949551807 [0,1,0,0,0,0|1,0,1]=3 996 B10R1.28 CC(C)(O)C1CNCCN1 MCULE-4741985821 [0,1,0,0,0,0|2,0,1]=4 997 B10R1.28 CC(C)(O)C1CNCCN1 MCULE-7744222183 [0,1,0,0,0,0|2,0,1]=4 998 B10R1.28 CC(C)(O)C1CNCCO1 MCULE-6011091311 [0,1,0,0,0,0|2,0,1]=4 999 B10R1.28 CC(C)(O)C1CNCCO1 MCULE-8361145061 [0,1,0,0,0,0|2,0,1]=4 1000 B10R1.28 CC(C)(O)[C@@H]1CCCNC1 MCULE-6499507594 [0,1,0,0,0,0|1,0,1]=3 1001 B10R1.28 CC(C)(O)[C@@H]1CNCCN1 MCULE-1563137159 [0,1,0,0,0,0|2,0,1]=4 1002 B10R1.28 CC(C)(O)[C@@H]1CNCCN1 MCULE-5979105786 [0,1,0,0,0,0|2,0,1]=4 1003 B10R1.28 CC(C)(O)[C@@H]1CNCCN1 MCULE-6401743155 [0,1,0,0,0,0|2,0,1]=4 1004 B10R1.28 CC(C)(O)[C@@H]1CNCCN1 MCULE-7324512741 [0,1,0,0,0,0|2,0,1]=4 1005 B10R1.28 CC(C)(O)[C@@H]1CNCCO1 MCULE-8065175270 [0,1,0,0,0,0|2,0,1]=4 1006 B10R1.28 CC(C)(O)[C@H]1CCCNC1 MCULE-7855651629 [0,1,0,0,0,0|1,0,1]=3 1007 B10R1.28 CS(=N)(=O)C1CCCCC1 MCULE-2218558166 [0,1,0,0,0,0|3,0,0]=4 1008 B10R1.28 CS(=O)(=O)C1CCCNC1 MCULE-4056216482 [0,1,0,0,0,0|1,0,1]=3 1009 B10R1.28 CS(=O)(=O)C1CCCNC1 MCULE-7610964302 [0,1,0,0,0,0|1,0,1]=3 1010 B10R1.28 CS(=O)(=O)[C@@H]1CCCNC1 MCULE-5056762085 [0,1,0,0,0,0|1,0,1]=3 1011 B10R1.28 CS(=O)(=O)[C@@H]1CCCNC1 MCULE-5589719682 [0,1,0,0,0,0|1,0,1]=3 1012 B10R1.28 CS(=O)(=O)[C@@H]1CCCNC1 MCULE-8556136110 [0,1,0,0,0,0|1,0,1]=3 1013 B10R1.28 CS(=O)(=O)[C@@H]1CCCNC1 MCULE-9714949011 [0,1,0,0,0,0|1,0,1]=3 1014 B10R1.28 CS(=O)(=O)[C@H]1CCCNC1 MCULE-2794307239 [0,1,0,0,0,0|1,0,1]=3 1015 B10R1.28 CS(=O)(=O)[C@H]1CCCNC1 MCULE-4616188061 [0,1,0,0,0,0|1,0,1]=3 1016 B10R1.28 CS(=O)(=O)[C@H]1CCCNC1 MCULE-8454796180 [0,1,0,0,0,0|1,0,1]=3 1017 B10R1.28 CS(=O)(=O)[C@H]1CCCNC1 MCULE-8533134889 [0,1,0,0,0,0|1,0,1]=3 1018 B10R1.28 C[Si](O)(O)C1CCCCC1 MCULE-8560323344 [0,1,0,0,0,0|1,1,1]=4 1019 B10R1.28 FC(F)(F)C1CCCNC1 MCULE-3449734361 [0,1,0,0,0,0|2,0,1]=4 1020 B10R1.28 FC(F)(F)C1CCCNC1 MCULE-7440296508 [0,1,0,0,0,0|2,0,1]=4 1021 B10R1.28 FC(F)(F)[C@@H]1CCCNC1 MCULE-1023922424 [0,1,0,0,0,0|2,0,1]=4 1022 B10R1.28 FC(F)(F)[C@@H]1CCCNC1 MCULE-1785640252 [0,1,0,0,0,0|2,0,1]=4 1023 B10R1.28 FC(F)(F)[C@@H]1CCCNC1 MCULE-3551799424 [0,1,0,0,0,0|2,0,1]=4 1024 B10R1.28 FC(F)(F)[C@@H]1CCCNC1 MCULE-4987732899 [0,1,0,0,0,0|2,0,1]=4 1025 B10R1.28 FC(F)(F)[C@H]1CCCNC1 MCULE-2162530371 [0,1,0,0,0,0|2,0,1]=4 1026 B10R1.28 FC(F)(F)[C@H]1CCCNC1 MCULE-5174915199 [0,1,0,0,0,0|2,0,1]=4 1027 B10R1.28 FC(F)(F)[C@H]1CCCNC1 MCULE-7353690072 [0,1,0,0,0,0|2,0,1]=4 1028 B10R1.28 FC(F)(F)[C@H]1CCCNC1 MCULE-9005364556 [0,1,0,0,0,0|2,0,1]=4 1029 B10R1.28 NS(=O)(=O)C1CCCCC1 MCULE-8130786931 [0,1,0,0,0,0|2,0,1]=4 1030 B10R1.28 NS(=O)(=O)C1CCCNC1 MCULE-2467386435 [0,1,0,0,0,0|1,0,1]=3 1031 B10R1.28 NS(=O)(=O)C1CCCNC1 MCULE-4292528214 [0,1,0,0,0,0|1,0,1]=3 1032 B10R1.28 NS(=O)(=O)C1CCCOC1 MCULE-4083499383 [0,1,0,0,0,0|2,0,1]=4 1033 B10R1.28 O=P(O)(O)C1CCCCC1 MCULE-5721503179 [0,1,0,0,0,0|2,0,0]=3 1034 B10R1.28 O=S(=O)(Cl)C1CCCCC1 MCULE-2631624673 [0,1,0,0,0,0|2,0,1]=4 1035 B10R1.28 O=S(=O)(F)C1CCCCC1 MCULE-6960893139 [0,1,0,0,0,0|2,0,1]=4 1036 B10R1.28 O=S(=O)(F)C1CCCNC1 MCULE-5305922030 [0,1,0,0,0,0|1,0,1]=3 1037 B10R1.28 O=S(=O)(F)C1CCCNC1 MCULE-6888001997 [0,1,0,0,0,0|1,0,1]=3 1038 B10R1.28 O=S(=O)(O)C1CCCNC1 MCULE-3529161221 [0,1,0,0,0,0|1,0,0]=2 1039 B10R1.28 O=S(=O)(O)C1CCNCC1 MCULE-8375087442 [0,1,0,0,0,0|3,0,0]=4 1040 B10R1.28 O=S(=O)([O-])C1CCCCC1 MCULE-1609125847 [0,1,0,0,0,0|2,0,1]=4 1041 B10R1.28 O=S(=O)([O-])C1CCCCC1 MCULE-7319949517 [0,1,0,0,0,0|2,0,1]=4 1042 B10R1.61 CC(=O)C1CCCCC1=O MCULE-4487262627 [0,1,0,0,0,0|2,0,1]=4 1043 B10R1.61 CC(=O)C1CCCCC1C MCULE-9283684652 [0,1,0,0,0,0|2,0,0]=3 1044 B10R1.61 CC(=O)C1CCCCC1F MCULE-4625331195 [0,1,0,0,0,0|2,0,0]=3 1045 B10R1.61 CC(=O)C1CCCCC1N MCULE-2419182932 [0,1,0,0,0,0|2,0,0]=3 1046 B10R1.61 CC(=O)C1CCCCC1N MCULE-6311029678 [0,1,0,0,0,0|2,0,0]=3 1047 B10R1.61 CC(=O)C1NCCCC1C MCULE-2230049407 [0,1,0,0,0,0|3,0,0]=4 1048 B10R1.61 CC(=O)C1NCCCC1C MCULE-8677498528 [0,1,0,0,0,0|3,0,0]=4 1049 B10R1.61 CC1=C(CCCC1)C(=O)O MCULE-2899177590 [0,1,0,0,0,0|1,0,2]=4 1050 B10R1.61 CC1=C(CCCO1)C(=O)O MCULE-1778977864 [0,1,0,0,0,0|1,0,2]=4 1051 B10R1.61 CC1CC=CCC1C(=O)O MCULE-9141456284 [0,1,0,0,0,0|1,0,1]=3 1052 B10R1.61 CC1CCCC=C1C(=O)O MCULE-2002913109 [0,1,0,0,0,0|1,0,2]=4 1053 B10R1.61 CC1CCCCC1C(=O)Cl MCULE-7597713129 [0,1,0,0,0,0|2,0,0]=3 1054 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [0,1,0,0,0,0|1,0,0]=2 1055 B10R1.61 CC1CCCCN1C(=O)Cl MCULE-6389946008 [0,1,0,0,0,0|3,0,0]=4 1056 B10R1.61 CC1CCCNC1C(=O)N MCULE-8821146640 [0,1,0,0,0,0|3,0,0]=4 1057 B10R1.61 CC1CCNCC1C(=O)O MCULE-8748624987 [0,1,0,0,0,0|0,0,0]=1 1058 B10R1.61 CC1CCNCC1C(=O)O MCULE-9934986088 [0,1,0,0,0,0|0,0,0]=1 1059 B10R1.61 CC1CNCCC1C(=O)O MCULE-4662714630 [0,1,0,0,0,0|2,0,0]=3 1060 B10R1.61 CC1CNCCC1C(=O)O MCULE-7019458300 [0,1,0,0,0,0|2,0,0]=3 1061 B10R1.61 CC1COCCC1C(=O)O MCULE-3541844170 [0,1,0,0,0,0|2,0,0]=3 1062 B10R1.61 CC1NCCCC1C(=O)O MCULE-1657397096 [0,1,0,0,0,0|0,0,0]=1 1063 B10R1.61 CC1NCCCC1C(=O)O MCULE-3297923255 [0,1,0,0,0,0|0,0,0]=1 1064 B10R1.61 CC1OCCCC1C(=O)O MCULE-1412449239 [0,1,0,0,0,0|1,0,0]=2 1065 B10R1.61 CC1OCCNC1C(=O)O MCULE-7650728786 [0,1,0,0,0,0|2,0,0]=3 1066 B10R1.61 CC1OCCNC1C(=O)O MCULE-7980002158 [0,1,0,0,0,0|2,0,0]=3 1067 B10R1.61 CN(C)C1CNCCC1O MCULE-1492532415 [0,1,0,0,0,0|3,0,0]=4 1068 B10R1.61 CN(C)C1CNCCC1O MCULE-8511272961 [0,1,0,0,0,0|3,0,0]=4 1069 B10R1.61 CN(C)[C@H]1CNCC[C@@H]1O MCULE-7617382971 [0,1,0,0,0,0|3,0,0]=4 1070 B10R1.61 CN(C)[C@H]1CNCC[C@@H]1O MCULE-9708566056 [0,1,0,0,0,0|3,0,0]=4 1071 B10R1.61 CN(C)[C@H]1CNCC[C@H]1O MCULE-5966246027 [0,1,0,0,0,0|3,0,0]=4 1072 B10R1.61 CN(C)[C@H]1CNCC[C@H]1O MCULE-9524138378 [0,1,0,0,0,0|3,0,0]=4 1073 B10R1.61 CN1CCCCC1C(=O)O MCULE-3456275150 [0,1,0,0,0,0|2,0,0]=3 1074 B10R1.61 CN1CCCCC1C(=O)O MCULE-6372652181 [0,1,0,0,0,0|2,0,0]=3 1075 B10R1.61 CN1CCCCC1C(=O)O MCULE-7834522939 [0,1,0,0,0,0|2,0,0]=3 1076 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2245294368 [0,1,0,0,0,0|2,0,0]=3 1077 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2258119449 [0,1,0,0,0,0|2,0,0]=3 1078 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-4757725445 [0,1,0,0,0,0|2,0,0]=3 1079 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-9648696079 [0,1,0,0,0,0|2,0,0]=3 1080 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5396822712 [0,1,0,0,0,0|2,0,0]=3 1081 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5529863786 [0,1,0,0,0,0|2,0,0]=3 1082 B10R1.61 CN1CCNCC1C(=O)N MCULE-5869045526 [0,1,0,0,0,0|2,0,0]=3 1083 B10R1.61 CN1CCNCC1C(=O)N MCULE-6913155408 [0,1,0,0,0,0|2,0,0]=3 1084 B10R1.61 CN1CCNCC1C(=O)O MCULE-1461373192 [0,1,0,0,0,0|1,0,0]=2 1085 B10R1.61 CN1CCNCC1C(=O)O MCULE-2314108697 [0,1,0,0,0,0|1,0,0]=2 1086 B10R1.61 CN1CCNCC1C(=O)O MCULE-6876364616 [0,1,0,0,0,0|1,0,0]=2 1087 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-6844980804 [0,1,0,0,0,0|1,0,0]=2 1088 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-9108769184 [0,1,0,0,0,0|1,0,0]=2 1089 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-5706230528 [0,1,0,0,0,0|1,0,0]=2 1090 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-6493932779 [0,1,0,0,0,0|1,0,0]=2 1091 B10R1.61 CN1CCOCC1C(=O)O MCULE-3133710690 [0,1,0,0,0,0|2,0,0]=3 1092 B10R1.61 CN1CCOCC1C(=O)O MCULE-3290676693 [0,1,0,0,0,0|2,0,0]=3 1093 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1062473078 [0,1,0,0,0,0|2,0,0]=3 1094 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1353468073 [0,1,0,0,0,0|2,0,0]=3 1095 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-2754171059 [0,1,0,0,0,0|2,0,0]=3 1096 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-8165717473 [0,1,0,0,0,0|2,0,0]=3 1097 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4042448961 [0,1,0,0,0,0|2,0,0]=3 1098 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4563667791 [0,1,0,0,0,0|2,0,0]=3 1099 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-6824999437 [0,1,0,0,0,0|2,0,0]=3 1100 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-9114074540 [0,1,0,0,0,0|2,0,0]=3 1101 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-1327276849 [0,1,0,0,0,0|3,0,0]=4 1102 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-3578282795 [0,1,0,0,0,0|3,0,0]=4 1103 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-5453839569 [0,1,0,0,0,0|0,0,0]=1 1104 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-8712948607 [0,1,0,0,0,0|0,0,0]=1 1105 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O MCULE-4097586923 [0,1,0,0,0,0|0,0,0]=1 1106 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-5754974970 [0,1,0,0,0,0|2,0,0]=3 1107 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-9389286375 [0,1,0,0,0,0|2,0,0]=3 1108 B10R1.61 C[C@H]1NCCC[C@@H]1C(=O)O MCULE-1705027594 [0,1,0,0,0,0|0,0,0]=1 1109 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8221283836 [0,1,0,0,0,0|0,0,0]=1 1110 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8542699735 [0,1,0,0,0,0|0,0,0]=1 1111 B10R1.61 C[C@H]1OCCC[C@H]1C(=O)O MCULE-9860065784 [0,1,0,0,0,0|1,0,0]=2 1112 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-1879170734 [0,1,0,0,0,0|2,0,0]=3 1113 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4061314927 [0,1,0,0,0,0|2,0,0]=3 1114 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4489336660 [0,1,0,0,0,0|2,0,0]=3 1115 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4667134552 [0,1,0,0,0,0|2,0,0]=3 1116 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-5449945964 [0,1,0,0,0,0|2,0,0]=3 1117 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-7387257453 [0,1,0,0,0,0|2,0,0]=3 1118 B10R1.61 NC(=O)C1CC=CCC1N MCULE-2161108232 [0,1,0,0,0,0|2,0,1]=4 1119 B10R1.61 NC(=O)C1CC=CCC1N MCULE-3871276776 [0,1,0,0,0,0|2,0,1]=4 1120 B10R1.61 NC(=O)C1CCCCC1=O MCULE-4980594289 [0,1,0,0,0,0|2,0,1]=4 1121 B10R1.61 NC(=O)C1CCCCC1N MCULE-2662216069 [0,1,0,0,0,0|2,0,0]=3 1122 B10R1.61 NC(=O)C1CCCCC1N MCULE-7467804033 [0,1,0,0,0,0|2,0,0]=3 1123 B10R1.61 NC(=O)C1CCCNC1=O MCULE-9308439620 [0,1,0,0,0,0|1,0,1]=3 1124 B10R1.61 NC(=O)C1CNCCC1=O MCULE-5445807694 [0,1,0,0,0,0|1,0,1]=3 1125 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-2158727978 [0,1,0,0,0,0|2,0,1]=4 1126 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-4418712159 [0,1,0,0,0,0|2,0,1]=4 1127 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-4498785860 [0,1,0,0,0,0|2,0,1]=4 1128 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-4657399850 [0,1,0,0,0,0|2,0,1]=4 1129 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-8109711316 [0,1,0,0,0,0|2,0,1]=4 1130 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-8970935013 [0,1,0,0,0,0|2,0,1]=4 1131 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-2263565157 [0,1,0,0,0,0|2,0,0]=3 1132 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-4928808183 [0,1,0,0,0,0|2,0,0]=3 1133 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-3135295628 [0,1,0,0,0,0|2,0,0]=3 1134 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-6221057684 [0,1,0,0,0,0|2,0,0]=3 1135 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-8654148060 [0,1,0,0,0,0|2,0,0]=3 1136 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-9581516213 [0,1,0,0,0,0|2,0,0]=3 1137 B10R1.61 NC1=C(CCCC1)C(=O)O MCULE-4360190675 [0,1,0,0,0,0|1,0,2]=4 1138 B10R1.61 NC1C=CCCC1C(=O)O MCULE-4465863020 [0,1,0,0,0,0|1,0,1]=3 1139 B10R1.61 NC1C=CCCC1C(=O)O MCULE-7419185648 [0,1,0,0,0,0|1,0,1]=3 1140 B10R1.61 NC1CC=CCC1C(=O)O MCULE-1611474561 [0,1,0,0,0,0|1,0,1]=3 1141 B10R1.61 NC1CC=CCC1C(=O)O MCULE-7218542670 [0,1,0,0,0,0|1,0,1]=3 1142 B10R1.61 NC1CCCCC1C(=O)O MCULE-4736252154 [0,1,0,0,0,0|1,0,0]=2 1143 B10R1.61 NC1CCCCC1C(=O)O MCULE-6203238767 [0,1,0,0,0,0|1,0,0]=2 1144 B10R1.61 NC1COCCC1C(=O)O MCULE-3475622537 [0,1,0,0,0,0|2,0,0]=3 1145 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-5919685636 [0,1,0,0,0,0|1,0,1]=3 1146 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-7012622007 [0,1,0,0,0,0|1,0,1]=3 1147 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-7228704167 [0,1,0,0,0,0|1,0,1]=3 1148 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-2340179433 [0,1,0,0,0,0|1,0,1]=3 1149 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-5382709957 [0,1,0,0,0,0|1,0,1]=3 1150 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-5760660665 [0,1,0,0,0,0|1,0,1]=3 1151 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-7312327841 [0,1,0,0,0,0|1,0,1]=3 1152 B10R1.61 N[C@@H]1CC=CC[C@H]1C(=O)O MCULE-6730051789 [0,1,0,0,0,0|1,0,1]=3 1153 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1790728170 [0,1,0,0,0,0|1,0,0]=2 1154 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-3150171920 [0,1,0,0,0,0|1,0,0]=2 1155 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4600025587 [0,1,0,0,0,0|1,0,0]=2 1156 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-9708582870 [0,1,0,0,0,0|1,0,0]=2 1157 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-3088249896 [0,1,0,0,0,0|1,0,0]=2 1158 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-4663931442 [0,1,0,0,0,0|1,0,0]=2 1159 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-6017464144 [0,1,0,0,0,0|1,0,0]=2 1160 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-9507759371 [0,1,0,0,0,0|1,0,0]=2 1161 B10R1.61 N[C@H]1C=CCC[C@H]1C(=O)O MCULE-1084812750 [0,1,0,0,0,0|1,0,1]=3 1162 B10R1.61 N[C@H]1C=CCC[C@H]1C(=O)O MCULE-7223852983 [0,1,0,0,0,0|1,0,1]=3 1163 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-2088008231 [0,1,0,0,0,0|1,0,1]=3 1164 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-2783014205 [0,1,0,0,0,0|1,0,1]=3 1165 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-4211428411 [0,1,0,0,0,0|1,0,1]=3 1166 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-6091505598 [0,1,0,0,0,0|1,0,1]=3 1167 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-2040720562 [0,1,0,0,0,0|1,0,0]=2 1168 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-5411687824 [0,1,0,0,0,0|1,0,0]=2 1169 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-6353451287 [0,1,0,0,0,0|1,0,0]=2 1170 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-9744443114 [0,1,0,0,0,0|1,0,0]=2 1171 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-1070315128 [0,1,0,0,0,0|1,0,0]=2 1172 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-2665445473 [0,1,0,0,0,0|1,0,0]=2 1173 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-5776301031 [0,1,0,0,0,0|1,0,0]=2 1174 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-7183400727 [0,1,0,0,0,0|1,0,0]=2 1175 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-4608934385 [0,1,0,0,0,0|2,0,0]=3 1176 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-7590284479 [0,1,0,0,0,0|2,0,0]=3 1177 B10R1.61 O=C(O)C1=C(CCCC1)Br MCULE-4432967237 [0,1,0,0,0,0|1,0,2]=4 1178 B10R1.61 O=C(O)C1=C(CCCC1)Cl MCULE-4191246644 [0,1,0,0,0,0|1,0,2]=4 1179 B10R1.61 O=C(O)C1=C(CCNC1)F MCULE-5950030289 [0,1,0,0,0,0|0,0,2]=3 1180 B10R1.61 O=C(O)C1=C(CCNC1)F MCULE-7466992226 [0,1,0,0,0,0|0,0,2]=3 1181 B10R1.61 O=C(O)C1=C(CCOC1)Cl MCULE-8616332165 [0,1,0,0,0,0|1,0,2]=4 1182 B10R1.61 O=C(O)C1CCCCC1=O MCULE-1684765148 [0,1,0,0,0,0|1,0,1]=3 1183 B10R1.61 O=C(O)C1CCCCC1F MCULE-9495362772 [0,1,0,0,0,0|1,0,0]=2 1184 B10R1.61 O=C(O)C1CCCCC1O MCULE-4502285714 [0,1,0,0,0,0|1,0,0]=2 1185 B10R1.61 O=C(O)C1CCCCN1O MCULE-1338694603 [0,1,0,0,0,0|2,0,0]=3 1186 B10R1.61 O=C(O)C1CCCNC1=O MCULE-5733950200 [0,1,0,0,0,0|0,0,1]=2 1187 B10R1.61 O=C(O)C1CCNCC1F MCULE-5749357486 [0,1,0,0,0,0|2,0,0]=3 1188 B10R1.61 O=C(O)C1CCNCC1F MCULE-7431262807 [0,1,0,0,0,0|2,0,0]=3 1189 B10R1.61 O=C(O)C1CNCCC1=O MCULE-3624462455 [0,1,0,0,0,0|0,0,1]=2 1190 B10R1.61 O=C(O)C1NCCCC1O MCULE-2981139992 [0,1,0,0,0,0|2,0,0]=3 1191 B10R1.61 O=C(O)C1NCCNC1=O MCULE-5861499693 [0,1,0,0,0,0|1,0,1]=3 1192 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-2224593354 [0,1,0,0,0,0|2,0,0]=3 1193 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-3743184576 [0,1,0,0,0,0|2,0,0]=3 1194 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-2137327596 [0,1,0,0,0,0|2,0,0]=3 1195 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3028221093 [0,1,0,0,0,0|2,0,0]=3 1196 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3468221525 [0,1,0,0,0,0|2,0,0]=3 1197 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-5449397815 [0,1,0,0,0,0|2,0,0]=3 1198 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-2786788134 [0,1,0,0,0,0|2,0,0]=3 1199 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-3262303247 [0,1,0,0,0,0|2,0,0]=3 1200 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4026886814 [0,1,0,0,0,0|2,0,0]=3 1201 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4165843552 [0,1,0,0,0,0|2,0,0]=3 1202 B10R1.61 O=C([O-])C1CCCCC1=O MCULE-2483955816 [0,1,0,0,0,0|1,0,2]=4 1203 B10R1.61 O=C([O-])C1CCCCN1O MCULE-1323846734 [0,1,0,0,0,0|2,0,1]=4 1204 B10R1.61 O=N(=O)C1CCCCC1O MCULE-5815114332 [0,1,0,0,0,0|2,0,1]=4 1205 B10R1.113 CC(=O)C1CCCN(C1)C MCULE-4171786992 [0,1,0,0,0,0|1,0,0]=2 1206 B10R1.113 CC(=O)C1CCCN(C1)C MCULE-6409364695 [0,1,0,0,0,0|1,0,0]=2 1207 B10R1.113 CC(=O)C1CCNC(=O)C1 MCULE-9774471516 [0,1,0,0,0,0|3,0,0]=4 1208 B10R1.113 CC(=O)N1CCCC(=O)C1 MCULE-7455044173 [0,1,0,0,0,0|3,0,0]=4 1209 B10R1.113 CC(=O)N1CCCC(C1)Br MCULE-2395158010 [0,1,0,0,0,0|3,0,0]=4 1210 B10R1.113 CC(=O)N1CCCC(C1)C MCULE-5497136448 [0,1,0,0,0,0|3,0,0]=4 1211 B10R1.113 CC(=O)N1CCCC(C1)Cl MCULE-9659356353 [0,1,0,0,0,0|3,0,0]=4 1212 B10R1.113 CC(=O)N1CCCC(C1)I MCULE-6220033653 [0,1,0,0,0,0|3,0,0]=4 1213 B10R1.113 CC(=O)N1CCCC(C1)N MCULE-4642648861 [0,1,0,0,0,0|3,0,0]=4 1214 B10R1.113 CC(=O)N1CCCC(C1)N MCULE-7081928105 [0,1,0,0,0,0|3,0,0]=4 1215 B10R1.113 CC(=O)N1CCCC(C1)O MCULE-4557043332 [0,1,0,0,0,0|3,0,0]=4 1216 B10R1.113 CC(=O)N1CCC[C@@H](C1)Br MCULE-1763543062 [0,1,0,0,0,0|3,0,0]=4 1217 B10R1.113 CC(=O)N1CCC[C@@H](C1)Cl MCULE-4405318233 [0,1,0,0,0,0|3,0,0]=4 1218 B10R1.113 CC(=O)N1CCC[C@@H](C1)I MCULE-5702312890 [0,1,0,0,0,0|3,0,0]=4 1219 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-2900342300 [0,1,0,0,0,0|3,0,0]=4 1220 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-5325252584 [0,1,0,0,0,0|3,0,0]=4 1221 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-9462446118 [0,1,0,0,0,0|3,0,0]=4 1222 B10R1.113 CC(=O)N1CCC[C@@H](C1)O MCULE-1777848146 [0,1,0,0,0,0|3,0,0]=4 1223 B10R1.113 CC(=O)N1CCC[C@@H](C1)O MCULE-5198604448 [0,1,0,0,0,0|3,0,0]=4 1224 B10R1.113 CC(=O)N1CCC[C@H](C1)Br MCULE-3345623932 [0,1,0,0,0,0|3,0,0]=4 1225 B10R1.113 CC(=O)N1CCC[C@H](C1)Cl MCULE-5466650776 [0,1,0,0,0,0|3,0,0]=4 1226 B10R1.113 CC(=O)N1CCC[C@H](C1)I MCULE-7518944169 [0,1,0,0,0,0|3,0,0]=4 1227 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-2743229947 [0,1,0,0,0,0|3,0,0]=4 1228 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-2860088162 [0,1,0,0,0,0|3,0,0]=4 1229 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-5518465296 [0,1,0,0,0,0|3,0,0]=4 1230 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-8760084774 [0,1,0,0,0,0|3,0,0]=4 1231 B10R1.113 CC(=O)N1CCC[C@H](C1)O MCULE-4329362874 [0,1,0,0,0,0|3,0,0]=4 1232 B10R1.113 CC(=O)N1CCC[C@H](C1)O MCULE-8344466566 [0,1,0,0,0,0|3,0,0]=4 1233 B10R1.113 CC1=CCCC(C1)C(=O)O MCULE-1528958679 [0,1,0,0,0,0|1,0,1]=3 1234 B10R1.113 CC1=NCCC(N1)C(=O)O MCULE-8417553503 [0,1,0,0,0,0|3,0,0]=4 1235 B10R1.113 CC1=N[C@@H](CCN1)C(=O)O MCULE-2656568536 [0,1,0,0,0,0|3,0,0]=4 1236 B10R1.113 CC1=N[C@@H](CCN1)C(=O)O MCULE-4918579312 [0,1,0,0,0,0|3,0,0]=4 1237 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-7720743223 [0,1,0,0,0,0|2,0,0]=3 1238 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-8584436669 [0,1,0,0,0,0|2,0,0]=3 1239 B10R1.113 CC1CC(CCO1)C(=O)O MCULE-8051149188 [0,1,0,0,0,0|2,0,0]=3 1240 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [0,1,0,0,0,0|1,0,0]=2 1241 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [0,1,0,0,0,0|2,0,0]=3 1242 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [0,1,0,0,0,0|2,0,0]=3 1243 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [0,1,0,0,0,0|2,0,0]=3 1244 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [0,1,0,0,0,0|2,0,0]=3 1245 B10R1.113 CC1CCCN(C1)C(=O)Cl MCULE-9803843077 [0,1,0,0,0,0|3,0,0]=4 1246 B10R1.113 CC1CCNC(C1)C(=O)N MCULE-8372541866 [0,1,0,0,0,0|3,0,0]=4 1247 B10R1.113 CC1CCNC(C1)C(=O)O MCULE-7170086856 [0,1,0,0,0,0|2,0,0]=3 1248 B10R1.113 CC1CNCC(C1)C(=O)O MCULE-6208683659 [0,1,0,0,0,0|0,0,0]=1 1249 B10R1.113 CC1CNCC(C1)C(C)C MCULE-2137712344 [0,1,0,0,0,0|2,0,1]=4 1250 B10R1.113 CC1CNCC(C1)C(C)C MCULE-5758264212 [0,1,0,0,0,0|2,0,1]=4 1251 B10R1.113 CC1CNCC(O1)C(=O)N MCULE-4373996098 [0,1,0,0,0,0|2,0,0]=3 1252 B10R1.113 CC1CNCC(O1)C(=O)O MCULE-4851002529 [0,1,0,0,0,0|1,0,0]=2 1253 B10R1.113 CC1COCC(N1)C(=O)N MCULE-4300959650 [0,1,0,0,0,0|3,0,0]=4 1254 B10R1.113 CC1COCC(N1)C(=O)O MCULE-6739051094 [0,1,0,0,0,0|2,0,0]=3 1255 B10R1.113 CN1CCC=C(C1)C(=O)O MCULE-5778457701 [0,1,0,0,0,0|0,0,2]=3 1256 B10R1.113 CN1CCCC(C1)B(O)O MCULE-8560351993 [0,1,0,0,0,0|1,0,1]=3 1257 B10R1.113 CN1CCCC(C1)B(O)O MCULE-8599361175 [0,1,0,0,0,0|1,0,1]=3 1258 B10R1.113 CN1CCCC(C1)C(=N)N MCULE-8556343048 [0,1,0,0,0,0|2,0,0]=3 1259 B10R1.113 CN1CCCC(C1)C(=N)N MCULE-9412786841 [0,1,0,0,0,0|2,0,0]=3 1260 B10R1.113 CN1CCCC(C1)C(=O)Cl MCULE-2256974113 [0,1,0,0,0,0|1,0,0]=2 1261 B10R1.113 CN1CCCC(C1)C(=O)Cl MCULE-6072454792 [0,1,0,0,0,0|1,0,0]=2 1262 B10R1.113 CN1CCCC(C1)C(=O)N MCULE-2482020070 [0,1,0,0,0,0|1,0,0]=2 1263 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-2577677138 [0,1,0,0,0,0|0,0,0]=1 1264 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-9093982856 [0,1,0,0,0,0|0,0,0]=1 1265 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3472059995 [0,1,0,0,0,0|0,0,0]=1 1266 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3661518240 [0,1,0,0,0,0|0,0,0]=1 1267 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-4244061094 [0,1,0,0,0,0|0,0,0]=1 1268 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-1368409828 [0,1,0,0,0,0|0,0,0]=1 1269 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-2079226353 [0,1,0,0,0,0|0,0,0]=1 1270 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-3257789162 [0,1,0,0,0,0|2,0,0]=3 1271 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-6597619500 [0,1,0,0,0,0|2,0,0]=3 1272 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-2247528725 [0,1,0,0,0,0|1,0,0]=2 1273 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-9094338983 [0,1,0,0,0,0|1,0,0]=2 1274 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-5238925665 [0,1,0,0,0,0|1,0,0]=2 1275 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-6341643779 [0,1,0,0,0,0|1,0,0]=2 1276 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-1518073789 [0,1,0,0,0,0|1,0,0]=2 1277 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-8312508233 [0,1,0,0,0,0|1,0,0]=2 1278 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-5046751827 [0,1,0,0,0,0|1,0,0]=2 1279 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-8819512874 [0,1,0,0,0,0|1,0,0]=2 1280 B10R1.113 CN1CCOC(C1)C(=S)N MCULE-1304435248 [0,1,0,0,0,0|2,1,0]=4 1281 B10R1.113 CS(=O)C1CCCC(C1)N MCULE-3230262975 [0,1,0,0,0,0|3,0,0]=4 1282 B10R1.113 CS(=O)C1CCCC(C1)O MCULE-2451665084 [0,1,0,0,0,0|3,0,0]=4 1283 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [0,1,0,0,0,0|1,0,0]=2 1284 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [0,1,0,0,0,0|2,0,0]=3 1285 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [0,1,0,0,0,0|2,0,0]=3 1286 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [0,1,0,0,0,0|1,0,0]=2 1287 B10R1.113 C[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-6382189211 [0,1,0,0,0,0|2,0,0]=3 1288 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-3220705725 [0,1,0,0,0,0|2,0,0]=3 1289 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-4368703620 [0,1,0,0,0,0|2,0,0]=3 1290 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5852226290 [0,1,0,0,0,0|2,0,0]=3 1291 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-8448888283 [0,1,0,0,0,0|2,0,0]=3 1292 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-6787897599 [0,1,0,0,0,0|0,0,0]=1 1293 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-7011808441 [0,1,0,0,0,0|0,0,0]=1 1294 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-1640808929 [0,1,0,0,0,0|1,0,0]=2 1295 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-5152957457 [0,1,0,0,0,0|1,0,0]=2 1296 B10R1.113 C[C@@H]1CNC[C@H](C1)C(=O)O MCULE-8762702780 [0,1,0,0,0,0|0,0,0]=1 1297 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-6500795104 [0,1,0,0,0,0|2,0,0]=3 1298 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-9135304432 [0,1,0,0,0,0|2,0,0]=3 1299 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [0,1,0,0,0,0|1,0,0]=2 1300 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [0,1,0,0,0,0|1,0,0]=2 1301 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3797871093 [0,1,0,0,0,0|2,0,0]=3 1302 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3813657182 [0,1,0,0,0,0|2,0,0]=3 1303 B10R1.113 C[C@H]1CCN[C@H](C1)C(=O)O MCULE-8048617173 [0,1,0,0,0,0|2,0,0]=3 1304 B10R1.113 C[C@H]1CNC[C@@H](C1)C(=O)O MCULE-9182357479 [0,1,0,0,0,0|0,0,0]=1 1305 B10R1.113 C[C@H]1CNC[C@H](C1)C(=O)O MCULE-7208949681 [0,1,0,0,0,0|0,0,0]=1 1306 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-3777490064 [0,1,0,0,0,0|2,0,0]=3 1307 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-7587755997 [0,1,0,0,0,0|2,0,0]=3 1308 B10R1.113 C[NH+]1CCC=C(C1)C(=O)O MCULE-8096594321 [0,1,0,0,0,0|0,0,3]=4 1309 B10R1.113 NC(=O)C1CCCC(=O)C1 MCULE-3502536681 [0,1,0,0,0,0|2,0,0]=3 1310 B10R1.113 NC(=O)C1CCCC(C1)N MCULE-5887465193 [0,1,0,0,0,0|2,0,0]=3 1311 B10R1.113 NC(=O)N1CCCC(C1)N MCULE-6231215658 [0,1,0,0,0,0|3,0,0]=4 1312 B10R1.113 NC(=O)N1CCCC(C1)N MCULE-7051693066 [0,1,0,0,0,0|3,0,0]=4 1313 B10R1.113 NC(=O)N1CCC[C@H](C1)N MCULE-7905125532 [0,1,0,0,0,0|3,0,0]=4 1314 B10R1.113 NC(=O)N1CCC[C@H](C1)N MCULE-9518047308 [0,1,0,0,0,0|3,0,0]=4 1315 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-1352569589 [0,1,0,0,0,0|2,0,0]=3 1316 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3084012877 [0,1,0,0,0,0|2,0,0]=3 1317 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3571668618 [0,1,0,0,0,0|2,0,0]=3 1318 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3930179934 [0,1,0,0,0,0|2,0,0]=3 1319 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-4308750395 [0,1,0,0,0,0|1,0,1]=3 1320 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-5984594154 [0,1,0,0,0,0|1,0,1]=3 1321 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-1721377644 [0,1,0,0,0,0|1,0,0]=2 1322 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-3598251126 [0,1,0,0,0,0|1,0,0]=2 1323 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7071803947 [0,1,0,0,0,0|2,0,0]=3 1324 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7129710557 [0,1,0,0,0,0|2,0,0]=3 1325 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-5349723370 [0,1,0,0,0,0|1,0,1]=3 1326 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-8912699325 [0,1,0,0,0,0|1,0,1]=3 1327 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5563204448 [0,1,0,0,0,0|1,0,0]=2 1328 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5798146682 [0,1,0,0,0,0|1,0,0]=2 1329 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-8105249419 [0,1,0,0,0,0|1,0,0]=2 1330 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-9161171059 [0,1,0,0,0,0|1,0,0]=2 1331 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2713838733 [0,1,0,0,0,0|1,0,0]=2 1332 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2810146308 [0,1,0,0,0,0|1,0,0]=2 1333 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-3141762073 [0,1,0,0,0,0|1,0,0]=2 1334 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-6970045085 [0,1,0,0,0,0|1,0,0]=2 1335 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-5264166397 [0,1,0,0,0,0|2,0,0]=3 1336 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-6153195788 [0,1,0,0,0,0|2,0,0]=3 1337 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-1166952810 [0,1,0,0,0,0|1,0,1]=3 1338 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-4761766781 [0,1,0,0,0,0|1,0,1]=3 1339 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-3283868687 [0,1,0,0,0,0|1,0,0]=2 1340 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-5009823003 [0,1,0,0,0,0|1,0,0]=2 1341 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-6716939610 [0,1,0,0,0,0|1,0,0]=2 1342 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-8264766500 [0,1,0,0,0,0|1,0,0]=2 1343 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-1016300044 [0,1,0,0,0,0|1,0,0]=2 1344 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-2730367375 [0,1,0,0,0,0|1,0,0]=2 1345 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3326410223 [0,1,0,0,0,0|1,0,0]=2 1346 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3370817462 [0,1,0,0,0,0|1,0,0]=2 1347 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3467671648 [0,1,0,0,0,0|1,0,0]=2 1348 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-7929171022 [0,1,0,0,0,0|1,0,0]=2 1349 B10R1.113 O=C(O)C1=CC(CCC1)O MCULE-3053514968 [0,1,0,0,0,0|1,0,2]=4 1350 B10R1.113 O=C(O)C1=CS(=O)CCC1 MCULE-4974730957 [0,1,0,0,0,0|1,0,2]=4 1351 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-2758341308 [0,1,0,0,0,0|2,0,0]=3 1352 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-7585455422 [0,1,0,0,0,0|2,0,0]=3 1353 B10R1.113 O=C(O)C1CCCC(C1)F MCULE-2589850350 [0,1,0,0,0,0|1,0,0]=2 1354 B10R1.113 O=C(O)C1CCCC(C1)O MCULE-9068909742 [0,1,0,0,0,0|1,0,0]=2 1355 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-1307689360 [0,1,0,0,0,0|0,0,0]=1 1356 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-6671293935 [0,1,0,0,0,0|0,0,0]=1 1357 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [0,1,0,0,0,0|2,0,0]=3 1358 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [0,1,0,0,0,0|2,0,0]=3 1359 B10R1.113 O=C(O)[C@@H]1CC=C[C@@H](C1)O MCULE-3205925226 [0,1,0,0,0,0|1,0,1]=3 1360 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-1509835362 [0,1,0,0,0,0|1,0,0]=2 1361 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-2282540668 [0,1,0,0,0,0|1,0,0]=2 1362 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-2678948022 [0,1,0,0,0,0|1,0,0]=2 1363 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-6048774329 [0,1,0,0,0,0|1,0,0]=2 1364 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-1390000123 [0,1,0,0,0,0|2,0,0]=3 1365 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-5873942206 [0,1,0,0,0,0|2,0,0]=3 1366 B10R1.113 O=C(O)[C@@H]1C[C@H](CCN1)O MCULE-5317131791 [0,1,0,0,0,0|2,0,0]=3 1367 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-1308626340 [0,1,0,0,0,0|1,0,0]=2 1368 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-5789638591 [0,1,0,0,0,0|1,0,0]=2 1369 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3370494896 [0,1,0,0,0,0|1,0,0]=2 1370 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3728932412 [0,1,0,0,0,0|1,0,0]=2 1371 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1474484031 [0,1,0,0,0,0|2,0,0]=3 1372 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1820373402 [0,1,0,0,0,0|2,0,0]=3 1373 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4771226737 [0,1,0,0,0,0|2,0,0]=3 1374 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4907773186 [0,1,0,0,0,0|2,0,0]=3 1375 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-8175624129 [0,1,0,0,0,0|2,0,0]=3 1376 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-4751772547 [0,1,0,0,0,0|2,0,0]=3 1377 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-6686826243 [0,1,0,0,0,0|2,0,0]=3 1378 B10R1.113 O=C1C=C(CCC1)C(=O)O MCULE-6477437107 [0,1,0,0,0,0|1,0,2]=4 1379 B10R1.113 O=C1C=CCC(C1)C(=O)O MCULE-3511234259 [0,1,0,0,0,0|1,0,2]=4 1380 B10R1.113 O=C1CC(CCN1)C(=O)O MCULE-8037650535 [0,1,0,0,0,0|2,0,0]=3 1381 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-4653652849 [0,1,0,0,0,0|1,0,1]=3 1382 B10R1.113 O=C1CC(CNN1)C(=O)O MCULE-5555795045 [0,1,0,0,0,0|1,0,1]=3 1383 B10R1.113 O=C1CCCC(C1)B(O)O MCULE-4346596975 [0,1,0,0,0,0|2,0,1]=4 1384 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [0,1,0,0,0,0|1,0,0]=2 1385 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9444010827 [0,1,0,0,0,0|2,0,0]=3 1386 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9607599809 [0,1,0,0,0,0|2,0,0]=3 1387 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [0,1,0,0,0,0|1,0,0]=2 1388 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-3091454903 [0,1,0,0,0,0|2,0,0]=3 1389 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-5853502175 [0,1,0,0,0,0|2,0,0]=3 1390 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [0,1,0,0,0,0|1,0,0]=2 1391 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-6509598163 [0,1,0,0,0,0|2,0,0]=3 1392 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-7646943695 [0,1,0,0,0,0|2,0,0]=3 1393 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [0,1,0,0,0,0|2,0,0]=3 1394 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [0,1,0,0,0,0|2,0,0]=3 1395 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [0,1,0,0,0,0|2,0,0]=3 1396 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [0,1,0,0,0,0|2,0,0]=3 1397 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [0,1,0,0,0,0|2,0,0]=3 1398 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [0,1,0,0,0,0|2,0,0]=3 1399 B10R1.113 O=C1CNCC(N1)C(=O)O MCULE-4117148380 [0,1,0,0,0,0|1,0,1]=3 1400 B10R1.113 O=C1CNC[C@@H](N1)C(=O)O MCULE-3006600193 [0,1,0,0,0,0|1,0,1]=3 1401 B10R1.113 O=C1CNC[C@H](N1)C(=O)O MCULE-4345470043 [0,1,0,0,0,0|1,0,1]=3 1402 B10R1.113 O=C1CSCC(N1)C(=O)O MCULE-7630386798 [0,1,0,0,0,0|2,0,1]=4 1403 B10R1.113 O=C1CSC[C@H](N1)C(=O)O MCULE-1412113570 [0,1,0,0,0,0|2,0,1]=4 1404 B10R1.113 O=C1C[C@@H](CCN1)C(=O)O MCULE-5205458306 [0,1,0,0,0,0|2,0,0]=3 1405 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-6254957663 [0,1,0,0,0,0|2,0,0]=3 1406 B10R1.113 O=C1C[C@H](CCN1)C(=O)O MCULE-9670666580 [0,1,0,0,0,0|2,0,0]=3 1407 B10R1.113 O=C1NC(CCO1)C(=O)O MCULE-4281750243 [0,1,0,0,0,0|3,0,0]=4 1408 B10R1.113 O=C1NCCC(N1)C(=O)O MCULE-6196729766 [0,1,0,0,0,0|3,0,0]=4 1409 B10R1.113 O=C1NCCC(O1)C(=O)O MCULE-1272116406 [0,1,0,0,0,0|3,0,0]=4 1410 B10R1.113 O=C1N[C@@H](CCO1)C(=O)O MCULE-7121690603 [0,1,0,0,0,0|3,0,0]=4 1411 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [0,1,0,0,0,0|2,0,0]=3 1412 B10R1.113 [C@H]1(CCCN(C1)C)C(=O)O MCULE-4364645223 [0,1,0,0,0,0|0,0,0]=1 1413 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-2539251802 [0,1,0,0,0,0|1,0,0]=2 1414 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-4407634771 [0,1,0,0,0,0|1,0,0]=2 1415 B10R1.363 CC(=O)C1(CCCCC1)Br MCULE-1087745376 [0,1,0,0,0,0|2,0,0]=3 1416 B10R1.363 CC(=O)C1(CCCCC1)C MCULE-2400194377 [0,1,0,0,0,0|2,0,0]=3 1417 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-2403671270 [0,1,0,0,0,0|2,0,0]=3 1418 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-8220968252 [0,1,0,0,0,0|2,0,0]=3 1419 B10R1.363 CC(=O)C1(CCCCC1)O MCULE-8708554984 [0,1,0,0,0,0|2,0,0]=3 1420 B10R1.363 CC(=O)C1(CCNCC1)C MCULE-2089718696 [0,1,0,0,0,0|3,0,0]=4 1421 B10R1.363 CC(=O)C1(CCNCC1)C MCULE-3448978894 [0,1,0,0,0,0|3,0,0]=4 1422 B10R1.363 CC(=O)C1(CCOCC1)C MCULE-6994899414 [0,1,0,0,0,0|3,0,0]=4 1423 B10R1.363 CC(=O)C1(CCOCC1)O MCULE-4174424855 [0,1,0,0,0,0|3,0,0]=4 1424 B10R1.363 CC(=O)C1(COCOC1)C MCULE-2297528523 [0,1,0,0,0,0|3,0,0]=4 1425 B10R1.363 CC(C)C1(CCCNC1)O MCULE-1108740966 [0,1,0,0,0,0|2,0,1]=4 1426 B10R1.363 CC(C)C1(CCCNC1)O MCULE-4551402880 [0,1,0,0,0,0|2,0,1]=4 1427 B10R1.363 CC1(C=CCCC1)C(=O)O MCULE-7610148262 [0,1,0,0,0,0|1,0,1]=3 1428 B10R1.363 CC1(CC=CCC1)C(=O)N MCULE-8468605392 [0,1,0,0,0,0|2,0,1]=4 1429 B10R1.363 CC1(CC=CCC1)C(=O)O MCULE-5814640957 [0,1,0,0,0,0|1,0,1]=3 1430 B10R1.363 CC1(CCCCC1)C(=O)Cl MCULE-2304699201 [0,1,0,0,0,0|2,0,0]=3 1431 B10R1.363 CC1(CCCCC1)C(=O)N MCULE-2748976288 [0,1,0,0,0,0|2,0,0]=3 1432 B10R1.363 CC1(CCCCC1)C(=O)O MCULE-8617368211 [0,1,0,0,0,0|1,0,0]=2 1433 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-5510028076 [0,1,0,0,0,0|3,0,0]=4 1434 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-9010382394 [0,1,0,0,0,0|3,0,0]=4 1435 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-4353837718 [0,1,0,0,0,0|2,0,0]=3 1436 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-5823768018 [0,1,0,0,0,0|2,0,0]=3 1437 B10R1.363 CC1(CCCCO1)C(=O)O MCULE-8167039984 [0,1,0,0,0,0|2,0,0]=3 1438 B10R1.363 CC1(CCCNC1)C(=O)N MCULE-6281064804 [0,1,0,0,0,0|1,0,0]=2 1439 B10R1.363 CC1(CCCNC1)C(=O)N MCULE-7011930506 [0,1,0,0,0,0|1,0,0]=2 1440 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-1830247756 [0,1,0,0,0,0|0,0,0]=1 1441 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-4554317503 [0,1,0,0,0,0|0,0,0]=1 1442 B10R1.363 CC1(CCCOC1)C(=O)O MCULE-3722771180 [0,1,0,0,0,0|1,0,0]=2 1443 B10R1.363 CC1(CCNCC1)C(=O)N MCULE-1830846193 [0,1,0,0,0,0|3,0,0]=4 1444 B10R1.363 CC1(CCNCC1)C(=O)N MCULE-7847544229 [0,1,0,0,0,0|3,0,0]=4 1445 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-5925956345 [0,1,0,0,0,0|2,0,0]=3 1446 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-9595642308 [0,1,0,0,0,0|2,0,0]=3 1447 B10R1.363 CC1(CCOCC1)C(=O)O MCULE-6824729734 [0,1,0,0,0,0|2,0,0]=3 1448 B10R1.363 CC1(CCSCC1)C(=O)O MCULE-4494370785 [0,1,0,0,0,0|2,0,0]=3 1449 B10R1.363 CC1(CNCCO1)C(=O)N MCULE-9521473906 [0,1,0,0,0,0|2,0,0]=3 1450 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-6864976931 [0,1,0,0,0,0|1,0,0]=2 1451 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-7815848744 [0,1,0,0,0,0|1,0,0]=2 1452 B10R1.363 CC1(COCCN1)C(=O)O MCULE-2577762263 [0,1,0,0,0,0|2,0,0]=3 1453 B10R1.363 CC1(COCCN1)C(=O)O MCULE-4596611063 [0,1,0,0,0,0|2,0,0]=3 1454 B10R1.363 CC1(COCCO1)C(=O)O MCULE-5074851185 [0,1,0,0,0,0|2,0,0]=3 1455 B10R1.363 CC1(COCOC1)C(=O)O MCULE-7267825356 [0,1,0,0,0,0|2,0,0]=3 1456 B10R1.363 CN(C)C1(CCCNC1)C MCULE-2859096864 [0,1,0,0,0,0|3,0,0]=4 1457 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-2751244606 [0,1,0,0,0,0|2,0,0]=3 1458 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-9588562839 [0,1,0,0,0,0|2,0,0]=3 1459 B10R1.363 C[C@@]1(CCCCO1)C(=O)O MCULE-8351337180 [0,1,0,0,0,0|2,0,0]=3 1460 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-2580172241 [0,1,0,0,0,0|0,0,0]=1 1461 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-5735574050 [0,1,0,0,0,0|0,0,0]=1 1462 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-6097682986 [0,1,0,0,0,0|0,0,0]=1 1463 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-8361078667 [0,1,0,0,0,0|0,0,0]=1 1464 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-2019738412 [0,1,0,0,0,0|2,0,0]=3 1465 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-5663835052 [0,1,0,0,0,0|2,0,0]=3 1466 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-8254704116 [0,1,0,0,0,0|2,0,0]=3 1467 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-1520204390 [0,1,0,0,0,0|2,0,0]=3 1468 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-5357080399 [0,1,0,0,0,0|2,0,0]=3 1469 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-4789999853 [0,1,0,0,0,0|0,0,0]=1 1470 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-5338426663 [0,1,0,0,0,0|0,0,0]=1 1471 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-6021049561 [0,1,0,0,0,0|0,0,0]=1 1472 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-7816386590 [0,1,0,0,0,0|0,0,0]=1 1473 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-2241799409 [0,1,0,0,0,0|3,0,0]=4 1474 B10R1.363 N=C(N)C1(CCCCC1)O MCULE-4555567865 [0,1,0,0,0,0|3,0,0]=4 1475 B10R1.363 NC(=O)C1(CCCCC1)N MCULE-9213834644 [0,1,0,0,0,0|2,0,0]=3 1476 B10R1.363 NC(=O)C1(CCCCC1)O MCULE-9953817877 [0,1,0,0,0,0|2,0,0]=3 1477 B10R1.363 NC(=O)C1(CCCNC1)O MCULE-5624973083 [0,1,0,0,0,0|1,0,0]=2 1478 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-1637528026 [0,1,0,0,0,0|3,0,0]=4 1479 B10R1.363 NC(=O)C1(CCNCC1)O MCULE-9426392755 [0,1,0,0,0,0|3,0,0]=4 1480 B10R1.363 NC(=O)C1(CCOCC1)N MCULE-2419590647 [0,1,0,0,0,0|3,0,0]=4 1481 B10R1.363 NC(=O)C1(CCOCC1)N MCULE-4475585786 [0,1,0,0,0,0|3,0,0]=4 1482 B10R1.363 NC(=O)C1(CCOCC1)O MCULE-6043002573 [0,1,0,0,0,0|3,0,0]=4 1483 B10R1.363 NC(=O)C1(CCSCC1)N MCULE-4385733187 [0,1,0,0,0,0|3,0,0]=4 1484 B10R1.363 NC(=O)C1(CCSCC1)O MCULE-5322321936 [0,1,0,0,0,0|3,0,0]=4 1485 B10R1.363 NC1(CCCCC1)C(=O)O MCULE-9219404299 [0,1,0,0,0,0|1,0,0]=2 1486 B10R1.363 NC1(CCCOC1)C(=O)O MCULE-7592747043 [0,1,0,0,0,0|1,0,0]=2 1487 B10R1.363 NC1(CCCSC1)C(=O)O MCULE-5875012341 [0,1,0,0,0,0|1,0,0]=2 1488 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-2468722313 [0,1,0,0,0,0|2,0,0]=3 1489 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-4525710147 [0,1,0,0,0,0|2,0,0]=3 1490 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-5856930946 [0,1,0,0,0,0|2,0,0]=3 1491 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-8458518802 [0,1,0,0,0,0|2,0,0]=3 1492 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-8720926076 [0,1,0,0,0,0|2,0,0]=3 1493 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-9032013861 [0,1,0,0,0,0|2,0,0]=3 1494 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-3400288648 [0,1,0,0,0,0|2,0,0]=3 1495 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-7826194478 [0,1,0,0,0,0|2,0,0]=3 1496 B10R1.363 O=C(Cl)C1(CCCCC1)Br MCULE-3943135228 [0,1,0,0,0,0|2,0,0]=3 1497 B10R1.363 O=C(Cl)C1(CCCCC1)Cl MCULE-5594029874 [0,1,0,0,0,0|2,0,0]=3 1498 B10R1.363 O=C(O)C1(CCCCC1)Br MCULE-4457572618 [0,1,0,0,0,0|1,0,0]=2 1499 B10R1.363 O=C(O)C1(CCCCC1)Cl MCULE-9172453010 [0,1,0,0,0,0|1,0,0]=2 1500 B10R1.363 O=C(O)C1(CCCCC1)F MCULE-6566089811 [0,1,0,0,0,0|1,0,0]=2 1501 B10R1.363 O=C(O)C1(CCCCC1)O MCULE-8504861268 [0,1,0,0,0,0|1,0,0]=2 1502 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-4880129058 [0,1,0,0,0,0|0,0,0]=1 1503 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-9960592206 [0,1,0,0,0,0|0,0,0]=1 1504 B10R1.363 O=C(O)C1(CCCOC1)F MCULE-8290066035 [0,1,0,0,0,0|1,0,0]=2 1505 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-1312767997 [0,1,0,0,0,0|2,0,0]=3 1506 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-5915477961 [0,1,0,0,0,0|2,0,0]=3 1507 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-4619147711 [0,1,0,0,0,0|2,0,0]=3 1508 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-6538244346 [0,1,0,0,0,0|2,0,0]=3 1509 B10R1.363 O=C(O)C1(CCOCC1)F MCULE-7783441156 [0,1,0,0,0,0|2,0,0]=3 1510 B10R1.363 O=C(O)C1(CCOCC1)O MCULE-4186201239 [0,1,0,0,0,0|2,0,0]=3 1511 B10R1.363 O=C(O)C1(CCSCC1)O MCULE-8230713014 [0,1,0,0,0,0|2,0,0]=3 1512 B10R1.363 OC1(CCCNC1)C(F)F MCULE-3347969358 [0,1,0,0,0,0|2,0,1]=4 1513 B10R1.363 OC1(CCCNC1)C(F)F MCULE-9107832134 [0,1,0,0,0,0|2,0,1]=4 1514 B10R1.363 [NH3+]C1(CCCCC1)C(=O)O MCULE-1248384499 [0,1,0,0,0,0|1,0,0]=2 1515 B8R0.7 C#CCCCCC(=O)O MCULE-5828767633 [0,0,1,0,0,0|1,0,1]=3 1516 B8R0.7 C#CCCOCC(=O)O MCULE-5200842540 [0,0,1,0,0,0|2,0,1]=4 1517 B8R0.7 C#CCOCCC(=O)O MCULE-9710662304 [0,0,1,0,0,0|1,0,2]=4 1518 B8R0.7 C=C(Br)CCCCCC MCULE-3502674829 [0,0,1,0,0,0|3,0,0]=4 1519 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [0,0,1,0,0,0|3,0,0]=4 1520 B8R0.7 C=C(Cl)CCCCCC MCULE-4545659103 [0,0,1,0,0,0|3,0,0]=4 1521 B8R0.7 C=CCCCCC(=O)C MCULE-4268619428 [0,0,1,0,0,0|2,0,1]=4 1522 B8R0.7 C=CCCCCC(=O)O MCULE-1991116122 [0,0,1,0,0,0|1,0,1]=3 1523 B8R0.7 C=CCCNCC(=O)O MCULE-7775351645 [0,0,1,0,0,0|2,0,1]=4 1524 B8R0.7 C=CCCOCC(=O)O MCULE-8626594933 [0,0,1,0,0,0|2,0,1]=4 1525 B8R0.7 C=CCNCCC(=O)N MCULE-4087711448 [0,0,1,0,0,0|1,0,2]=4 1526 B8R0.7 C=CCOCCC(=O)O MCULE-6102747899 [0,0,1,0,0,0|1,0,2]=4 1527 B8R0.7 CC#CCCCC(=O)C MCULE-4297141774 [0,0,1,0,0,0|2,0,1]=4 1528 B8R0.7 CC#CCCCC(=O)O MCULE-2531382210 [0,0,1,0,0,0|1,0,1]=3 1529 B8R0.7 CC(=O)CCCCC#N MCULE-2841814511 [0,0,1,0,0,0|3,0,0]=4 1530 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [0,0,1,0,0,0|3,0,0]=4 1531 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [0,0,1,0,0,0|3,0,0]=4 1532 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [0,0,1,0,0,0|3,0,0]=4 1533 B8R0.7 CC=CCCCC(=O)C MCULE-7957571875 [0,0,1,0,0,0|2,0,1]=4 1534 B8R0.7 CC=CCCCC(=O)O MCULE-3300087433 [0,0,1,0,0,0|1,0,1]=3 1535 B8R0.7 CCCC/C=C/C(=O)O MCULE-6916224344 [0,0,1,0,0,0|1,0,2]=4 1536 B8R0.7 CCCC=CCC(=O)O MCULE-3879649411 [0,0,1,0,0,0|1,0,1]=3 1537 B8R0.7 CCCCC#CC(=O)O MCULE-4160128187 [0,0,1,0,0,0|1,0,2]=4 1538 B8R0.7 CCCCC=CC(=O)O MCULE-6837768730 [0,0,1,0,0,0|1,0,2]=4 1539 B8R0.7 CCCCCCB(O)O MCULE-6503959495 [0,0,1,0,0,0|2,0,1]=4 1540 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [0,0,1,0,0,0|2,0,0]=3 1541 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [0,0,1,0,0,0|2,0,0]=3 1542 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [0,0,1,0,0,0|2,0,0]=3 1543 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [0,0,1,0,0,0|1,0,0]=2 1544 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [0,0,1,0,0,0|1,0,1]=3 1545 B8R0.7 CCCCCCC(C)O MCULE-4635370769 [0,0,1,0,0,0|2,0,1]=4 1546 B8R0.7 CCCCCCC(C)O MCULE-5095200181 [0,0,1,0,0,0|2,0,1]=4 1547 B8R0.7 CCCCCCN(=O)=O MCULE-8283658415 [0,0,1,0,0,0|2,0,1]=4 1548 B8R0.7 CCCCCC[C@@H](C)O MCULE-5245235461 [0,0,1,0,0,0|2,0,1]=4 1549 B8R0.7 CCCCCC[C@@H](C)O MCULE-8537503782 [0,0,1,0,0,0|2,0,1]=4 1550 B8R0.7 CCCCCC[C@H](C)O MCULE-2655815413 [0,0,1,0,0,0|2,0,1]=4 1551 B8R0.7 CCCCCC[C@H](C)O MCULE-7784149103 [0,0,1,0,0,0|2,0,1]=4 1552 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [0,0,1,0,0,0|3,0,0]=4 1553 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [0,0,1,0,0,0|3,0,0]=4 1554 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [0,0,1,0,0,0|3,0,0]=4 1555 B8R0.7 CCCCNCC(=O)N MCULE-1276341431 [0,0,1,0,0,0|3,0,0]=4 1556 B8R0.7 CCCCNCC(=O)N MCULE-6579402071 [0,0,1,0,0,0|3,0,0]=4 1557 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [0,0,1,0,0,0|2,0,0]=3 1558 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [0,0,1,0,0,0|2,0,0]=3 1559 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [0,0,1,0,0,0|2,0,0]=3 1560 B8R0.7 CCCNCCC(=O)N MCULE-2654608736 [0,0,1,0,0,0|1,0,0]=2 1561 B8R0.7 CCCNCCC(=O)N MCULE-2683588523 [0,0,1,0,0,0|1,0,0]=2 1562 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [0,0,1,0,0,0|0,0,0]=1 1563 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [0,0,1,0,0,0|0,0,0]=1 1564 B8R0.7 CCCNCCN(C)C MCULE-1838736190 [0,0,1,0,0,0|3,0,0]=4 1565 B8R0.7 CCCNCCN(C)C MCULE-5165444564 [0,0,1,0,0,0|3,0,0]=4 1566 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [0,0,1,0,0,0|1,0,0]=2 1567 B8R0.7 CCCSC=CC(=O)O MCULE-3074287995 [0,0,1,0,0,0|1,0,2]=4 1568 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [0,0,1,0,0,0|1,0,0]=2 1569 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [0,0,1,0,0,0|2,0,0]=3 1570 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [0,0,1,0,0,0|2,0,0]=3 1571 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [0,0,1,0,0,0|2,0,0]=3 1572 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [0,0,1,0,0,0|0,0,0]=1 1573 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [0,0,1,0,0,0|0,0,0]=1 1574 B8R0.7 CNCCCCN(C)C MCULE-2625950434 [0,0,1,0,0,0|3,0,0]=4 1575 B8R0.7 CNCCCCN(C)C MCULE-2643427865 [0,0,1,0,0,0|3,0,0]=4 1576 B8R0.7 CNCCCNC(=O)C MCULE-2682619502 [0,0,1,0,0,0|2,0,0]=3 1577 B8R0.7 CNCCCNC(=O)C MCULE-3477977807 [0,0,1,0,0,0|2,0,0]=3 1578 B8R0.7 CNCCCNC(=S)S MCULE-3322917565 [0,0,1,0,0,0|1,2,0]=4 1579 B8R0.7 CNCCOCC(=O)O MCULE-5408672373 [0,0,1,0,0,0|1,0,0]=2 1580 B8R0.7 COCCCCB(O)O MCULE-5339704839 [0,0,1,0,0,0|2,0,1]=4 1581 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [0,0,1,0,0,0|1,0,0]=2 1582 B8R0.7 COCCCCN(=O)=O MCULE-3527542330 [0,0,1,0,0,0|2,0,1]=4 1583 B8R0.7 COCCCNC(=O)C MCULE-4149128250 [0,0,1,0,0,0|3,0,0]=4 1584 B8R0.7 COCCCNC(=O)N MCULE-4038737956 [0,0,1,0,0,0|3,0,0]=4 1585 B8R0.7 COCCNCC(=O)N MCULE-2300508230 [0,0,1,0,0,0|3,0,0]=4 1586 B8R0.7 COCCNCC(=O)N MCULE-7059174365 [0,0,1,0,0,0|3,0,0]=4 1587 B8R0.7 COCCNCC(=O)O MCULE-2703110743 [0,0,1,0,0,0|2,0,0]=3 1588 B8R0.7 COCCNCC(=O)O MCULE-5854004501 [0,0,1,0,0,0|2,0,0]=3 1589 B8R0.7 COCCOCC(=O)C MCULE-5956367525 [0,0,1,0,0,0|3,0,0]=4 1590 B8R0.7 COCCOCC(=O)Cl MCULE-9321414156 [0,0,1,0,0,0|3,0,0]=4 1591 B8R0.7 COCCOCC(=O)N MCULE-8987780803 [0,0,1,0,0,0|3,0,0]=4 1592 B8R0.7 COCCOCC(=O)O MCULE-2561278418 [0,0,1,0,0,0|2,0,0]=3 1593 B8R0.7 COCCSCC(=O)O MCULE-2908610834 [0,0,1,0,0,0|2,0,0]=3 1594 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [0,0,1,0,0,0|1,0,0]=2 1595 B8R0.7 CSCCCOC(=O)C MCULE-4403232519 [0,0,1,0,0,0|3,0,0]=4 1596 B8R0.7 CSCCNCC(=O)O MCULE-1747724833 [0,0,1,0,0,0|2,0,0]=3 1597 B8R0.7 CSCCNCC(=O)O MCULE-9991325079 [0,0,1,0,0,0|2,0,0]=3 1598 B8R0.7 CSCCOCC(=O)O MCULE-2038020159 [0,0,1,0,0,0|2,0,0]=3 1599 B8R0.7 CSSCCCC(=O)O MCULE-7947744639 [0,0,1,0,0,0|2,0,0]=3 1600 B8R0.7 N#CCCCCC(=O)N MCULE-7791035164 [0,0,1,0,0,0|3,0,0]=4 1601 B8R0.7 N#CCCCCC(=O)O MCULE-1900756226 [0,0,1,0,0,0|2,0,0]=3 1602 B8R0.7 N#CCCNCC(=O)O MCULE-9226456604 [0,0,1,0,0,0|3,0,0]=4 1603 B8R0.7 N#N=NCCCC(=O)O MCULE-1397586704 [0,0,1,0,0,0|2,0,1]=4 1604 B8R0.7 NC(=O)CCCCCBr MCULE-6938202710 [0,0,1,0,0,0|3,0,0]=4 1605 B8R0.7 NC(=O)CCCCCO MCULE-2654184294 [0,0,1,0,0,0|3,0,0]=4 1606 B8R0.7 NC(=O)CCNCCS MCULE-4682566242 [0,0,1,0,0,0|2,0,0]=3 1607 B8R0.7 NCCCCCC(=O)N MCULE-1692086577 [0,0,1,0,0,0|3,0,0]=4 1608 B8R0.7 NCCCCCC(=O)N MCULE-2191237198 [0,0,1,0,0,0|3,0,0]=4 1609 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [0,0,1,0,0,0|2,0,0]=3 1610 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [0,0,1,0,0,0|2,0,0]=3 1611 B8R0.7 NCCCCCC(=O)[O-] MCULE-7336458907 [0,0,1,0,0,0|2,0,1]=4 1612 B8R0.7 NCCCNCC(=O)O MCULE-6526080048 [0,0,1,0,0,0|3,0,0]=4 1613 B8R0.7 NCCCNCC(=O)O MCULE-6762903438 [0,0,1,0,0,0|3,0,0]=4 1614 B8R0.7 NCCCOCC(=O)O MCULE-6428539436 [0,0,1,0,0,0|3,0,0]=4 1615 B8R0.7 NCCNCCC(=O)O MCULE-6596967912 [0,0,1,0,0,0|1,0,0]=2 1616 B8R0.7 NCCNCCC(=O)[O-] MCULE-8896439746 [0,0,1,0,0,0|1,0,1]=3 1617 B8R0.7 NCCOCCC(=O)O MCULE-8535110656 [0,0,1,0,0,0|2,0,0]=3 1618 B8R0.7 NCCOCCC(=O)O MCULE-9124828795 [0,0,1,0,0,0|2,0,0]=3 1619 B8R0.7 NCCSCCC(=O)O MCULE-5309234181 [0,0,1,0,0,0|2,0,0]=3 1620 B8R0.7 NOCCCCC(=O)O MCULE-2022616022 [0,0,1,0,0,0|2,0,0]=3 1621 B8R0.7 NOCCCCC(=O)O MCULE-9375312454 [0,0,1,0,0,0|2,0,0]=3 1622 B8R0.7 O=C(Cl)CCCCCBr MCULE-4314610726 [0,0,1,0,0,0|3,0,0]=4 1623 B8R0.7 O=C(Cl)CCCCCCl MCULE-4526081631 [0,0,1,0,0,0|3,0,0]=4 1624 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [0,0,1,0,0,0|2,0,0]=3 1625 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [0,0,1,0,0,0|2,0,0]=3 1626 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [0,0,1,0,0,0|2,0,0]=3 1627 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [0,0,1,0,0,0|2,0,0]=3 1628 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [0,0,1,0,0,0|2,0,0]=3 1629 B8R0.7 O=C(O)CCNCCO MCULE-6594831168 [0,0,1,0,0,0|1,0,0]=2 1630 B8R0.7 O=C(O)CCOCCBr MCULE-8991363781 [0,0,1,0,0,0|2,0,0]=3 1631 B8R0.7 O=C(O)CCOCCO MCULE-7271806926 [0,0,1,0,0,0|2,0,0]=3 1632 B8R0.7 O=C(O)CCOCCS MCULE-2136117046 [0,0,1,0,0,0|2,0,0]=3 1633 B8R0.7 O=C(O)CCSCCO MCULE-4689447674 [0,0,1,0,0,0|2,0,0]=3 1634 B8R0.7 O=C(O)COCCCBr MCULE-2393807719 [0,0,1,0,0,0|3,0,0]=4 1635 B8R0.7 O=C([O-])CCCCCCl MCULE-7341419838 [0,0,1,0,0,0|2,0,1]=4 1636 B8R0.7 O=C([O-])CCCCCO MCULE-5897469112 [0,0,1,0,0,0|2,0,1]=4 1637 B8R0.7 O=C([O-])CCCCCO MCULE-9397608140 [0,0,1,0,0,0|2,0,1]=4 1638 B8R0.7 O=CCCCCC(=O)O MCULE-8762346998 [0,0,1,0,0,0|2,0,0]=3 1639 B8R0.7 O=CNCCCC(=O)O MCULE-9120755173 [0,0,1,0,0,0|3,0,0]=4 1640 B8R0.8 C#CCCC(N)C(=O)O MCULE-2306841483 [0,0,1,0,0,0|2,0,1]=4 1641 B8R0.8 C#CCCC(O)C(=O)O MCULE-1983462487 [0,0,1,0,0,0|2,0,1]=4 1642 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-3328230047 [0,0,1,0,0,0|2,0,1]=4 1643 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-8588363102 [0,0,1,0,0,0|2,0,1]=4 1644 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-3269292516 [0,0,1,0,0,0|2,0,1]=4 1645 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6769399323 [0,0,1,0,0,0|2,0,1]=4 1646 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6930343823 [0,0,1,0,0,0|2,0,1]=4 1647 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-9522590396 [0,0,1,0,0,0|2,0,1]=4 1648 B8R0.8 C#CCOC(C)C(=O)O MCULE-7792481116 [0,0,1,0,0,0|2,0,1]=4 1649 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [0,0,1,0,0,0|3,0,0]=4 1650 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [0,0,1,0,0,0|3,0,0]=4 1651 B8R0.8 C=CCCC(C)C(=O)N MCULE-4187602833 [0,0,1,0,0,0|2,0,1]=4 1652 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [0,0,1,0,0,0|1,0,1]=3 1653 B8R0.8 C=CCCC(N)C(=O)O MCULE-1524160350 [0,0,1,0,0,0|2,0,1]=4 1654 B8R0.8 C=CCCC(N)C(=O)O MCULE-5522822192 [0,0,1,0,0,0|2,0,1]=4 1655 B8R0.8 C=CCCC(N)C(=O)O MCULE-7998584890 [0,0,1,0,0,0|2,0,1]=4 1656 B8R0.8 C=CCC[C@@H](N)C(=O)O MCULE-4571532321 [0,0,1,0,0,0|2,0,1]=4 1657 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-2235047291 [0,0,1,0,0,0|2,0,1]=4 1658 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-4644458098 [0,0,1,0,0,0|2,0,1]=4 1659 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-7821274952 [0,0,1,0,0,0|2,0,1]=4 1660 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-9807212949 [0,0,1,0,0,0|2,0,1]=4 1661 B8R0.8 C=CCOC(C)C(=O)O MCULE-4801958900 [0,0,1,0,0,0|2,0,1]=4 1662 B8R0.8 C=CCSC(C)C(=O)O MCULE-4683246165 [0,0,1,0,0,0|2,0,1]=4 1663 B8R0.8 CC#CCC(N)C(=O)O MCULE-2943446929 [0,0,1,0,0,0|2,0,1]=4 1664 B8R0.8 CC#CCC(N)C(=O)O MCULE-8126081664 [0,0,1,0,0,0|2,0,1]=4 1665 B8R0.8 CC#CC[C@@H](N)C(=O)O MCULE-5156383275 [0,0,1,0,0,0|2,0,1]=4 1666 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-4618959735 [0,0,1,0,0,0|2,0,1]=4 1667 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-7818390064 [0,0,1,0,0,0|2,0,1]=4 1668 B8R0.8 CC(=O)C(C)CCC#N MCULE-1571826766 [0,0,1,0,0,0|1,0,2]=4 1669 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [0,0,1,0,0,0|1,0,0]=2 1670 B8R0.8 CC(OCCN)C(=O)O MCULE-4117277894 [0,0,1,0,0,0|1,0,0]=2 1671 B8R0.8 CC(OCCN)C(=O)O MCULE-6407651037 [0,0,1,0,0,0|1,0,0]=2 1672 B8R0.8 CC(OCCO)C(=O)O MCULE-4305620136 [0,0,1,0,0,0|2,0,0]=3 1673 B8R0.8 CCC/C=C(\C)/C(=O)O MCULE-4080682767 [0,0,1,0,0,0|1,0,2]=4 1674 B8R0.8 CCCC=C(C)C(=O)O MCULE-1072900673 [0,0,1,0,0,0|1,0,2]=4 1675 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [0,0,1,0,0,0|2,0,1]=4 1676 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [0,0,1,0,0,0|3,0,0]=4 1677 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [0,0,1,0,0,0|2,0,0]=3 1678 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [0,0,1,0,0,0|2,0,0]=3 1679 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [0,0,1,0,0,0|2,0,0]=3 1680 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [0,0,1,0,0,0|2,0,0]=3 1681 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [0,0,1,0,0,0|1,0,0]=2 1682 B8R0.8 CCCCC(C)C(C)O MCULE-2881990446 [0,0,1,0,0,0|2,0,1]=4 1683 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [0,0,1,0,0,0|2,0,0]=3 1684 B8R0.8 CCCCC(N)C(=O)C MCULE-2471947344 [0,0,1,0,0,0|3,0,0]=4 1685 B8R0.8 CCCCC(N)C(=O)C MCULE-4947552776 [0,0,1,0,0,0|3,0,0]=4 1686 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [0,0,1,0,0,0|2,0,0]=3 1687 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [0,0,1,0,0,0|3,0,0]=4 1688 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [0,0,1,0,0,0|2,0,0]=3 1689 B8R0.8 CCCCN(C)C(=O)Cl MCULE-6884962631 [0,0,1,0,0,0|3,0,0]=4 1690 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [0,0,1,0,0,0|1,0,0]=2 1691 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [0,0,1,0,0,0|2,0,0]=3 1692 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [0,0,1,0,0,0|2,0,0]=3 1693 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [0,0,1,0,0,0|1,0,0]=2 1694 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [0,0,1,0,0,0|1,0,0]=2 1695 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [0,0,1,0,0,0|3,0,0]=4 1696 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [0,0,1,0,0,0|3,0,0]=4 1697 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [0,0,1,0,0,0|3,0,0]=4 1698 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [0,0,1,0,0,0|3,0,0]=4 1699 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [0,0,1,0,0,0|2,0,0]=3 1700 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [0,0,1,0,0,0|2,0,0]=3 1701 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [0,0,1,0,0,0|2,0,0]=3 1702 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [0,0,1,0,0,0|0,0,0]=1 1703 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [0,0,1,0,0,0|0,0,0]=1 1704 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [0,0,1,0,0,0|1,0,0]=2 1705 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [0,0,1,0,0,0|2,0,0]=3 1706 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [0,0,1,0,0,0|2,0,0]=3 1707 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [0,0,1,0,0,0|2,0,0]=3 1708 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [0,0,1,0,0,0|2,0,0]=3 1709 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [0,0,1,0,0,0|2,0,0]=3 1710 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [0,0,1,0,0,0|2,0,0]=3 1711 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [0,0,1,0,0,0|3,0,0]=4 1712 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [0,0,1,0,0,0|3,0,0]=4 1713 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [0,0,1,0,0,0|3,0,0]=4 1714 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [0,0,1,0,0,0|3,0,0]=4 1715 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [0,0,1,0,0,0|3,0,0]=4 1716 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [0,0,1,0,0,0|3,0,0]=4 1717 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [0,0,1,0,0,0|3,0,0]=4 1718 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [0,0,1,0,0,0|3,0,0]=4 1719 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [0,0,1,0,0,0|3,0,0]=4 1720 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [0,0,1,0,0,0|3,0,0]=4 1721 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [0,0,1,0,0,0|3,0,0]=4 1722 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [0,0,1,0,0,0|3,0,0]=4 1723 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [0,0,1,0,0,0|3,0,0]=4 1724 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [0,0,1,0,0,0|2,0,0]=3 1725 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [0,0,1,0,0,0|1,0,0]=2 1726 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [0,0,1,0,0,0|1,0,0]=2 1727 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [0,0,1,0,0,0|1,0,0]=2 1728 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [0,0,1,0,0,0|1,0,0]=2 1729 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [0,0,1,0,0,0|1,0,0]=2 1730 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [0,0,1,0,0,0|1,0,0]=2 1731 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [0,0,1,0,0,0|1,0,0]=2 1732 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [0,0,1,0,0,0|1,0,0]=2 1733 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [0,0,1,0,0,0|1,0,0]=2 1734 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [0,0,1,0,0,0|1,0,0]=2 1735 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [0,0,1,0,0,0|1,0,0]=2 1736 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [0,0,1,0,0,0|1,0,0]=2 1737 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [0,0,1,0,0,0|1,0,0]=2 1738 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [0,0,1,0,0,0|1,0,0]=2 1739 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [0,0,1,0,0,0|1,0,0]=2 1740 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [0,0,1,0,0,0|1,0,0]=2 1741 B8R0.8 NOCCC(N)C(=O)O MCULE-1540658941 [0,0,1,0,0,0|2,0,0]=3 1742 B8R0.8 NOCCC(N)C(=O)O MCULE-3729513992 [0,0,1,0,0,0|2,0,0]=3 1743 B8R0.8 NOCC[C@@H](N)C(=O)O MCULE-3273727827 [0,0,1,0,0,0|2,0,0]=3 1744 B8R0.8 NOCC[C@H](N)C(=O)O MCULE-2315172974 [0,0,1,0,0,0|2,0,0]=3 1745 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [0,0,1,0,0,0|2,0,0]=3 1746 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [0,0,1,0,0,0|2,0,0]=3 1747 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [0,0,1,0,0,0|2,0,0]=3 1748 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [0,0,1,0,0,0|2,0,1]=4 1749 B8R0.8 [C@@H](N)(CCC=C)C(=O)O MCULE-9648209291 [0,0,1,0,0,0|2,0,1]=4 1750 B8R0.8 [C@H](N)(CCON)C(=O)O MCULE-1309966773 [0,0,1,0,0,0|2,0,0]=3 1751 B8R0.15 C#CC(OCC)C(=O)O MCULE-4920328481 [0,0,1,0,0,0|2,0,1]=4 1752 B8R0.15 C=CCC(CC)C(=O)O MCULE-8599414655 [0,0,1,0,0,0|1,0,1]=3 1753 B8R0.15 CCC(CCN)C(=O)O MCULE-3540595708 [0,0,1,0,0,0|2,0,0]=3 1754 B8R0.15 CCC(CCN)C(=O)O MCULE-6369668711 [0,0,1,0,0,0|2,0,0]=3 1755 B8R0.15 CCC(NC=O)C(=O)O MCULE-6163876154 [0,0,1,0,0,0|3,0,0]=4 1756 B8R0.15 CCCC(C#N)C(=O)O MCULE-8231205596 [0,0,1,0,0,0|0,0,2]=3 1757 B8R0.15 CCCC(CC)C(=O)C MCULE-3483794250 [0,0,1,0,0,0|2,0,0]=3 1758 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [0,0,1,0,0,0|1,0,0]=2 1759 B8R0.15 CCCC(CN)N(C)C MCULE-7046503709 [0,0,1,0,0,0|3,0,0]=4 1760 B8R0.15 CCCC(CO)C(=O)O MCULE-2653026260 [0,0,1,0,0,0|1,0,0]=2 1761 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [0,0,1,0,0,0|2,0,0]=3 1762 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [0,0,1,0,0,0|2,0,0]=3 1763 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [0,0,1,0,0,0|2,0,0]=3 1764 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [0,0,1,0,0,0|2,0,0]=3 1765 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [0,0,1,0,0,0|2,0,0]=3 1766 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [0,0,1,0,0,0|2,0,0]=3 1767 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [0,0,1,0,0,0|2,0,0]=3 1768 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-1805025355 [0,0,1,0,0,0|1,0,0]=2 1769 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-3449491143 [0,0,1,0,0,0|1,0,0]=2 1770 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [0,0,1,0,0,0|2,0,0]=3 1771 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [0,0,1,0,0,0|2,0,0]=3 1772 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [0,0,1,0,0,0|2,0,0]=3 1773 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [0,0,1,0,0,0|2,0,0]=3 1774 B8R0.15 CCOC(CBr)C(=O)O MCULE-5345866284 [0,0,1,0,0,0|2,0,0]=3 1775 B8R0.15 CCOC(CC)C(=O)N MCULE-8093014638 [0,0,1,0,0,0|3,0,0]=4 1776 B8R0.15 CCOC(CC)C(=O)O MCULE-1674742787 [0,0,1,0,0,0|2,0,0]=3 1777 B8R0.15 CNC(CCN)C(=O)O MCULE-6687313255 [0,0,1,0,0,0|3,0,0]=4 1778 B8R0.15 CNC(COC)C(=O)N MCULE-9124173069 [0,0,1,0,0,0|3,0,0]=4 1779 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [0,0,1,0,0,0|2,0,0]=3 1780 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [0,0,1,0,0,0|2,0,0]=3 1781 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [0,0,1,0,0,0|3,0,0]=4 1782 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [0,0,1,0,0,0|3,0,0]=4 1783 B8R0.15 CN[C@@H](COC)C(=O)N MCULE-2651499559 [0,0,1,0,0,0|3,0,0]=4 1784 B8R0.15 CN[C@@H](COC)C(=O)N MCULE-2761071254 [0,0,1,0,0,0|3,0,0]=4 1785 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [0,0,1,0,0,0|3,0,0]=4 1786 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [0,0,1,0,0,0|3,0,0]=4 1787 B8R0.15 COC(CCN)C(=O)O MCULE-1510512790 [0,0,1,0,0,0|3,0,0]=4 1788 B8R0.15 COCC(OC)C(=O)O MCULE-5776685365 [0,0,1,0,0,0|2,0,0]=3 1789 B8R0.15 COCC(ON)C(=O)O MCULE-4466158339 [0,0,1,0,0,0|2,0,0]=3 1790 B8R0.15 COCC(ON)C(=O)O MCULE-6084078663 [0,0,1,0,0,0|2,0,0]=3 1791 B10R2.6 C1CCC(CC1)C2CO2 MCULE-7174463943 [0,0,0,1,0,0|2,0,1]=4 1792 B10R2.61 CN1C[C@H]2CNC[C@@H]1C2 MCULE-9244117385 [0,0,0,1,0,0|3,0,0]=4 1793 B10R2.61 O=C1CC2CCCC1C2 MCULE-9902349455 [0,0,0,1,0,0|2,0,0]=3 1794 B10R2.61 O=C1CC2COCC1C2 MCULE-6820169357 [0,0,0,1,0,0|2,0,0]=3 1795 B10R2.61 O=C1NC2CCCC1C2 MCULE-9859470381 [0,0,0,1,0,0|2,0,0]=3 1796 B10R2.61 O=C1NC2CCNC1C2 MCULE-4221823714 [0,0,0,1,0,0|3,0,0]=4 1797 B10R2.61 O=C1N[C@H]2CCC[C@@H]1C2 MCULE-2498857906 [0,0,0,1,0,0|2,0,0]=3 1798 B10R2.61 O=C1OC2C=CCC1C2 MCULE-3922449822 [0,0,0,1,0,0|1,0,1]=3 1799 B10R2.61 O=C1OC2CCNC1C2 MCULE-8392788767 [0,0,0,1,0,0|2,0,0]=3 1800 B10R2.61 O=C1OC2CCOC1C2 MCULE-4977323499 [0,0,0,1,0,0|2,0,0]=3 1801 B10R2.61 OC1CC2COCC1C2 MCULE-2752913110 [0,0,0,1,0,0|2,0,1]=4 1802 B10R2.61 OC1CN2CCCC1C2 MCULE-1746053554 [0,0,0,1,0,0|1,0,1]=3 1803 B10R2.61 OC1CN2CCCC1C2 MCULE-2589375847 [0,0,0,1,0,0|1,0,1]=3 1804 B10R2.61 [C@@H]12CNC[C@@H](C1)[C@@H](C2)O MCULE-7846556743 [0,0,0,1,0,0|1,0,1]=3 1805 B10R2.61 [C@H]12CCC[C@H](C1)C(=O)N2 MCULE-6927488861 [0,0,0,1,0,0|2,0,0]=3 1806 B10R2.62 C12CCC(CC1)C(=O)C2 MCULE-8282529338 [0,0,0,1,0,0|2,0,0]=3 1807 B10R2.62 C12CCC(CC1)C(=O)O2 MCULE-4611258343 [0,0,0,1,0,0|1,0,0]=2 1808 B10R2.62 CN1CC2CCC1CN2 MCULE-3621425466 [0,0,0,1,0,0|3,0,0]=4 1809 B10R2.62 CN1CC2CCC1CN2 MCULE-5760028994 [0,0,0,1,0,0|3,0,0]=4 1810 B10R2.62 O=C1CC2C=CC1CC2 MCULE-1084971182 [0,0,0,1,0,0|2,0,1]=4 1811 B10R2.62 O=C1CC2CCC1CC2 MCULE-8331389597 [0,0,0,1,0,0|2,0,0]=3 1812 B10R2.62 O=C1CC2CCC1CN2 MCULE-3732970881 [0,0,0,1,0,0|1,0,0]=2 1813 B10R2.62 O=C1CC2CCC1CN2 MCULE-5949700463 [0,0,0,1,0,0|1,0,0]=2 1814 B10R2.62 O=C1CN2CCC1CC2 MCULE-1582448541 [0,0,0,1,0,0|3,0,0]=4 1815 B10R2.62 O=C1C[C@H]2C=C[C@@H]1CC2 MCULE-6040839273 [0,0,0,1,0,0|2,0,1]=4 1816 B10R2.62 O=C1NC2CCC1CC2 MCULE-1572331637 [0,0,0,1,0,0|2,0,0]=3 1817 B10R2.62 O=C1OC2CCC1CC2 MCULE-7150392682 [0,0,0,1,0,0|1,0,0]=2 1818 B10R2.62 OC1CC2CCC1CC2 MCULE-5667751878 [0,0,0,1,0,0|2,0,1]=4 1819 B10R2.62 OC1CC2CCC1CN2 MCULE-1439426891 [0,0,0,1,0,0|1,0,1]=3 1820 B10R2.62 OC1CC2CCC1CN2 MCULE-5292530243 [0,0,0,1,0,0|1,0,1]=3 1821 B10R2.62 O[C@@H]1CC2CC[C@@H]1CN2 MCULE-4581347002 [0,0,0,1,0,0|1,0,1]=3 1822 B10R2.62 O[C@@H]1CC2CC[C@@H]1CN2 MCULE-7243199288 [0,0,0,1,0,0|1,0,1]=3 1823 B10R2.62 O[C@H]1CC2CC[C@@H]1CN2 MCULE-8030131903 [0,0,0,1,0,0|1,0,1]=3 1824 B10R2.62 [C@@H]12CC[C@@H](CN1)N(C2)C MCULE-5046815534 [0,0,0,1,0,0|3,0,0]=4 1825 B10R2.62 [C@H]12CC[C@H](CN1)N(C2)C MCULE-3736622779 [0,0,0,1,0,0|3,0,0]=4 1826 B10R2.62 [NH+]12CCC(CC1)C(=O)C2 MCULE-7751080008 [0,0,0,1,0,0|3,0,0]=4 1827 B10R2.188 FC1(C2CNCC1C2)F MCULE-1594324410 [0,0,0,1,0,0|2,0,1]=4 1828 B10R2.188 FC1(C2CNCC1C2)F MCULE-4415213506 [0,0,0,1,0,0|2,0,1]=4 1829 B10R2.196 FC1(C2C1CNCC2)F MCULE-7155303644 [0,0,0,1,0,0|2,0,1]=4 1830 B10R2.196 FC1(C2C1CNCC2)F MCULE-7899764923 [0,0,0,1,0,0|2,0,1]=4 1831 B10R2.196 FC1(C2C1NCCC2)F MCULE-2946203348 [0,0,0,1,0,0|2,0,1]=4 1832 B10R2.196 FC1(C2C1NCCC2)F MCULE-9029285937 [0,0,0,1,0,0|2,0,1]=4 1833 B10R2.196 [C@H]12CCNC[C@H]1C2(Br)Br MCULE-6147224523 [0,0,0,1,0,0|2,0,1]=4 1834 B10R2.320 C12CCNCC1N(C2)C MCULE-6687974155 [0,0,0,1,0,0|3,0,0]=4 1835 B10R2.320 CN1CC2C1CNCC2 MCULE-5544913302 [0,0,0,1,0,0|3,0,0]=4 1836 B10R2.320 CN1CC2C1CNCC2 MCULE-9412785080 [0,0,0,1,0,0|3,0,0]=4 1837 B10R2.320 CN1C[C@@H]2[C@H]1CNCC2 MCULE-4120763769 [0,0,0,1,0,0|3,0,0]=4 1838 B10R2.320 CN1C[C@@H]2[C@H]1CNCC2 MCULE-5770036343 [0,0,0,1,0,0|3,0,0]=4 1839 B10R2.320 O=C1CC2C1CCCC2 MCULE-8899093243 [0,0,0,1,0,0|2,0,0]=3 1840 B10R2.320 O=C1NC2C1CC=CC2 MCULE-2426219319 [0,0,0,1,0,0|2,0,1]=4 1841 B10R2.320 O=C1NC2C1CCC=C2 MCULE-5387390398 [0,0,0,1,0,0|2,0,1]=4 1842 B10R2.320 O=C1NC2C1CCCC2 MCULE-4769358198 [0,0,0,1,0,0|2,0,0]=3 1843 B10R2.320 [C@@H]12CNCC[C@@H]1CN2C MCULE-2772867376 [0,0,0,1,0,0|3,0,0]=4 1844 B10R2.320 [C@@H]12CNCC[C@@H]1CN2C MCULE-4750242127 [0,0,0,1,0,0|3,0,0]=4 1845 B10R2.320 [C@@H]12CNCC[C@@H]1CN2C MCULE-4950206369 [0,0,0,1,0,0|3,0,0]=4 1846 B10R2.320 [C@@H]12CNCC[C@@H]1CN2C MCULE-7388198191 [0,0,0,1,0,0|3,0,0]=4 1847 B10R2.344 O=C(O)C12CC1CCN2 MCULE-8958769379 [0,0,0,1,0,0|2,0,0]=3 1848 B10R2.344 O=C(O)C12CC1CCN2 MCULE-9918894627 [0,0,0,1,0,0|2,0,0]=3 1849 B10R2.344 O=C(O)C12CCCC1C2 MCULE-1433395114 [0,0,0,1,0,0|1,0,0]=2 1850 B10R2.344 O=C(O)C12CCNC1C2 MCULE-4622558327 [0,0,0,1,0,0|2,0,0]=3 1851 B10R2.344 O=C(O)C12CCNC1C2 MCULE-5876870827 [0,0,0,1,0,0|2,0,0]=3 1852 B10R2.344 O=C(O)C12CNCC1C2 MCULE-1023234959 [0,0,0,1,0,0|0,0,0]=1 1853 B10R2.344 O=C(O)C12CNCC1C2 MCULE-2698470641 [0,0,0,1,0,0|0,0,0]=1 1854 B10R2.344 O=C(O)C12COCC1C2 MCULE-4962599130 [0,0,0,1,0,0|1,0,0]=2 1855 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-8361805191 [0,0,0,1,0,0|2,0,0]=3 1856 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-9298532680 [0,0,0,1,0,0|2,0,0]=3 1857 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-5335382694 [0,0,0,1,0,0|1,0,0]=2 1858 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-6955865926 [0,0,0,1,0,0|1,0,0]=2 1859 B10R2.344 O=C(O)[C@]12COCC1C2 MCULE-6646373866 [0,0,0,1,0,0|1,0,0]=2 1860 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-1926490936 [0,0,0,1,0,0|1,0,0]=2 1861 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-4045090245 [0,0,0,1,0,0|1,0,0]=2 1862 B10R2.351 C12CNCC1C2C(=O)N MCULE-7561625164 [0,0,0,1,0,0|3,0,0]=4 1863 B10R2.351 CC(O)C1C2C1CCC2 MCULE-9430657221 [0,0,0,1,0,0|2,0,1]=4 1864 B10R2.351 NC(=O)C1C2C1CNC2 MCULE-6557910674 [0,0,0,1,0,0|3,0,0]=4 1865 B10R2.351 O=C(O)C1C2C1CCC2 MCULE-5457069948 [0,0,0,1,0,0|1,0,0]=2 1866 B10R2.351 O=C(O)C1C2C1CNC2 MCULE-2636221459 [0,0,0,1,0,0|2,0,0]=3 1867 B10R2.351 O=C(O)C1C2C1CNC2 MCULE-6853944528 [0,0,0,1,0,0|2,0,0]=3 1868 B10R2.351 O=C(O)C1C2C1COC2 MCULE-7410101644 [0,0,0,1,0,0|2,0,0]=3 1869 B10R2.351 O=C(O)C1C2C1OCC2 MCULE-7995568672 [0,0,0,1,0,0|1,0,0]=2 1870 B10R2.351 O=C(O)C1C2C1SC=C2 MCULE-8194712872 [0,0,0,1,0,0|1,0,2]=4 1871 B10R2.351 O=C(O)[C@@H]1[C@@H]2[C@H]1CNC2 MCULE-4336908718 [0,0,0,1,0,0|2,0,0]=3 1872 B10R2.351 O=C(O)[C@@H]1[C@@H]2[C@H]1COC2 MCULE-2602641452 [0,0,0,1,0,0|2,0,0]=3 1873 B10R2.351 O=C(O)[C@H]1[C@@H]2[C@H]1CNC2 MCULE-3047485005 [0,0,0,1,0,0|2,0,0]=3 1874 B10R2.351 O=C(O)[C@H]1[C@@H]2[C@H]1CNC2 MCULE-7215981155 [0,0,0,1,0,0|2,0,0]=3 1875 B10R2.351 [C@@H]12CNC[C@@H]1[C@H]2C(=O)O MCULE-8121766639 [0,0,0,1,0,0|2,0,0]=3 1876 B10R2.351 [C@H]12CNC[C@H]1[C@@H]2C(=O)N MCULE-2633595158 [0,0,0,1,0,0|3,0,0]=4 1877 B10R2.351 [C@H]12CNC[C@H]1[C@@H]2C(=O)N MCULE-4717722182 [0,0,0,1,0,0|3,0,0]=4 1878 B10R2.351 [C@H]12COC[C@H]1[C@H]2C(=O)O MCULE-2561176480 [0,0,0,1,0,0|2,0,0]=3 1879 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-8087821545 [0,0,0,1,0,0|2,0,0]=3 1880 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-9943749675 [0,0,0,1,0,0|2,0,0]=3 1881 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-3741942930 [0,0,0,1,0,0|2,0,0]=3 1882 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-8099098772 [0,0,0,1,0,0|2,0,0]=3 1883 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-6549710478 [0,0,0,1,0,0|2,0,0]=3 1884 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-7349536483 [0,0,0,1,0,0|2,0,0]=3 1885 B10R2.355 O=C(O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1865131686 [0,0,0,1,0,0|2,0,0]=3 1886 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-3923610209 [0,0,0,1,0,0|2,0,0]=3 1887 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-6551780838 [0,0,0,1,0,0|2,0,0]=3 1888 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-9694754423 [0,0,0,1,0,0|2,0,0]=3 1889 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-4493728887 [0,0,0,1,0,0|2,0,0]=3 1890 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8766409370 [0,0,0,1,0,0|2,0,0]=3 1891 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8840539566 [0,0,0,1,0,0|2,0,0]=3 1892 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-1970630066 [0,0,0,1,0,0|2,0,0]=3 1893 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-7946950016 [0,0,0,1,0,0|2,0,0]=3 1894 B10R2.355 [C@H]12C[C@H]1CN[C@@H]2C(=O)O MCULE-9408302039 [0,0,0,1,0,0|2,0,0]=3 1895 B10R2.355 [C@H]12C[C@H]1CN[C@H]2C(=O)O MCULE-4802776373 [0,0,0,1,0,0|2,0,0]=3 1896 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-4859115894 [0,0,0,1,0,0|3,0,0]=4 1897 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7323043594 [0,0,0,1,0,0|3,0,0]=4 1898 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7946144059 [0,0,0,1,0,0|3,0,0]=4 1899 B10R2.357 O=C(Cl)N1CC2CC2C1 MCULE-3221494355 [0,0,0,1,0,0|3,0,0]=4 1900 B10R2.357 O=C(O)C1CC2CC2C1 MCULE-9890442572 [0,0,0,1,0,0|1,0,0]=2 1901 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-4212410891 [0,0,0,1,0,0|2,0,0]=3 1902 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-5642169472 [0,0,0,1,0,0|2,0,0]=3 1903 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-6526449280 [0,0,0,1,0,0|2,0,0]=3 1904 B10R2.357 O=C(O)C1CC2OC2C1 MCULE-1665894100 [0,0,0,1,0,0|2,0,0]=3 1905 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8901519673 [0,0,0,1,0,0|2,0,0]=3 1906 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8974728452 [0,0,0,1,0,0|2,0,0]=3 1907 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-2251552616 [0,0,0,1,0,0|2,0,0]=3 1908 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-3670081653 [0,0,0,1,0,0|2,0,0]=3 1909 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-4127413852 [0,0,0,1,0,0|2,0,0]=3 1910 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-5543837378 [0,0,0,1,0,0|2,0,0]=3 1911 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2699537727 [0,0,0,1,0,0|2,0,0]=3 1912 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2957583599 [0,0,0,1,0,0|2,0,0]=3 1913 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-8019742930 [0,0,0,1,0,0|2,0,0]=3 1914 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-9906255485 [0,0,0,1,0,0|2,0,0]=3 1915 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-1783881546 [0,0,0,1,0,0|3,0,0]=4 1916 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-2191940678 [0,0,0,1,0,0|3,0,0]=4 1917 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-3269432034 [0,0,0,1,0,0|3,0,0]=4 1918 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-4463912241 [0,0,0,1,0,0|3,0,0]=4 1919 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6809518361 [0,0,0,1,0,0|3,0,0]=4 1920 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6941150528 [0,0,0,1,0,0|3,0,0]=4 1921 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9444667290 [0,0,0,1,0,0|3,0,0]=4 1922 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9739462821 [0,0,0,1,0,0|3,0,0]=4 1923 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-3004356941 [0,0,0,1,0,0|2,0,0]=3 1924 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-7104749205 [0,0,0,1,0,0|2,0,0]=3 1925 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-9522199577 [0,0,0,1,0,0|2,0,0]=3 1926 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [0,0,0,0,1,0|1,0,0]=2 1927 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [0,0,0,0,1,0|1,0,0]=2 1928 B8R1.7 C1(CCCN1)C(C)C MCULE-1193597619 [0,0,0,0,1,0|2,0,1]=4 1929 B8R1.7 C1(CCCN1)C(C)C MCULE-5005043134 [0,0,0,0,1,0|2,0,1]=4 1930 B8R1.7 C1(CCCN1)C(F)F MCULE-5617460277 [0,0,0,0,1,0|2,0,1]=4 1931 B8R1.7 C1(CCCN1)C(F)F MCULE-7529295267 [0,0,0,0,1,0|2,0,1]=4 1932 B8R1.7 C1(CCNC1)C(=O)N MCULE-4476688014 [0,0,0,0,1,0|1,0,0]=2 1933 B8R1.7 C1(CCNC1)C(=O)N MCULE-8592806332 [0,0,0,0,1,0|1,0,0]=2 1934 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [0,0,0,0,1,0|0,0,0]=1 1935 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [0,0,0,0,1,0|0,0,0]=1 1936 B8R1.7 C1(CCNC1)N(C)C MCULE-3990443245 [0,0,0,0,1,0|3,0,0]=4 1937 B8R1.7 C1(CCNC1)N(C)C MCULE-8002729209 [0,0,0,0,1,0|3,0,0]=4 1938 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [0,0,0,0,1,0|1,0,0]=2 1939 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [0,0,0,0,1,0|1,0,2]=4 1940 B8R1.7 CC(=O)C1CCC=N1 MCULE-5434976735 [0,0,0,0,1,0|1,0,2]=4 1941 B8R1.7 CC(=O)C1CCCC1 MCULE-7952211819 [0,0,0,0,1,0|1,0,0]=2 1942 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [0,0,0,0,1,0|1,0,0]=2 1943 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [0,0,0,0,1,0|1,0,0]=2 1944 B8R1.7 CC(=O)C1CCCO1 MCULE-7518147693 [0,0,0,0,1,0|2,0,0]=3 1945 B8R1.7 CC(=O)C1CCNC1 MCULE-2147779518 [0,0,0,0,1,0|1,0,0]=2 1946 B8R1.7 CC(=O)C1CCNC1 MCULE-2964372059 [0,0,0,0,1,0|1,0,0]=2 1947 B8R1.7 CC(=O)C1CCOC1 MCULE-2105633909 [0,0,0,0,1,0|2,0,0]=3 1948 B8R1.7 CC(=O)C1NCCS1 MCULE-4092674646 [0,0,0,0,1,0|2,0,0]=3 1949 B8R1.7 CC(=O)C1NCCS1 MCULE-8660367055 [0,0,0,0,1,0|2,0,0]=3 1950 B8R1.7 CC(=O)N1CCCC1 MCULE-6839528034 [0,0,0,0,1,0|2,0,0]=3 1951 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [0,0,0,0,1,0|1,0,0]=2 1952 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [0,0,0,0,1,0|1,0,0]=2 1953 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [0,0,0,0,1,0|1,0,0]=2 1954 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [0,0,0,0,1,0|1,0,0]=2 1955 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-2015960170 [0,0,0,0,1,0|2,0,0]=3 1956 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-3381319090 [0,0,0,0,1,0|2,0,0]=3 1957 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [0,0,0,0,1,0|1,0,0]=2 1958 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [0,0,0,0,1,0|1,0,0]=2 1959 B8R1.7 CC(=O)[C@H]1CCCO1 MCULE-5637204370 [0,0,0,0,1,0|2,0,0]=3 1960 B8R1.7 CC(Br)C1CCCC1 MCULE-9104958283 [0,0,0,0,1,0|2,0,1]=4 1961 B8R1.7 CC(C)C1CCCC1 MCULE-4905120936 [0,0,0,0,1,0|2,0,1]=4 1962 B8R1.7 CC(C)C1CCCN1 MCULE-2880698089 [0,0,0,0,1,0|2,0,1]=4 1963 B8R1.7 CC(C)C1CCCN1 MCULE-8748321913 [0,0,0,0,1,0|2,0,1]=4 1964 B8R1.7 CC(C)C1CCNC1 MCULE-6027927433 [0,0,0,0,1,0|2,0,1]=4 1965 B8R1.7 CC(C)C1CCNC1 MCULE-6061191970 [0,0,0,0,1,0|2,0,1]=4 1966 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-1080192326 [0,0,0,0,1,0|2,0,1]=4 1967 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-7041423474 [0,0,0,0,1,0|2,0,1]=4 1968 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-8923460014 [0,0,0,0,1,0|2,0,1]=4 1969 B8R1.7 CC(C)[C@@H]1CCCN1 MCULE-9332303275 [0,0,0,0,1,0|2,0,1]=4 1970 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-1312856988 [0,0,0,0,1,0|2,0,1]=4 1971 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-1454315799 [0,0,0,0,1,0|2,0,1]=4 1972 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-3512426569 [0,0,0,0,1,0|2,0,1]=4 1973 B8R1.7 CC(C)[C@@H]1CCNC1 MCULE-8210117113 [0,0,0,0,1,0|2,0,1]=4 1974 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-2217061634 [0,0,0,0,1,0|2,0,1]=4 1975 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7316037645 [0,0,0,0,1,0|2,0,1]=4 1976 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-7382792334 [0,0,0,0,1,0|2,0,1]=4 1977 B8R1.7 CC(C)[C@H]1CCCN1 MCULE-9823510614 [0,0,0,0,1,0|2,0,1]=4 1978 B8R1.7 CC(C)[C@H]1CCNC1 MCULE-6484346598 [0,0,0,0,1,0|2,0,1]=4 1979 B8R1.7 CC(C)[C@H]1CCNC1 MCULE-7637885012 [0,0,0,0,1,0|2,0,1]=4 1980 B8R1.7 CC(N)C1CCCC1 MCULE-1576719851 [0,0,0,0,1,0|2,0,1]=4 1981 B8R1.7 CC(N)C1CCCC1 MCULE-9047229690 [0,0,0,0,1,0|2,0,1]=4 1982 B8R1.7 CC(O)C1CCCC1 MCULE-6730583511 [0,0,0,0,1,0|1,0,1]=3 1983 B8R1.7 CC(O)C1CCCO1 MCULE-2804362263 [0,0,0,0,1,0|2,0,1]=4 1984 B8R1.7 CC(O)C1CCNC1 MCULE-3316354505 [0,0,0,0,1,0|1,0,1]=3 1985 B8R1.7 CC(O)C1CCNC1 MCULE-6188875194 [0,0,0,0,1,0|1,0,1]=3 1986 B8R1.7 CC(O)C1CCOC1 MCULE-1059653145 [0,0,0,0,1,0|2,0,1]=4 1987 B8R1.7 CN(C)C1CCCC1 MCULE-2157359156 [0,0,0,0,1,0|3,0,0]=4 1988 B8R1.7 CN(C)C1CCNC1 MCULE-3714972935 [0,0,0,0,1,0|3,0,0]=4 1989 B8R1.7 CN(C)C1CCNC1 MCULE-6606642659 [0,0,0,0,1,0|3,0,0]=4 1990 B8R1.7 CN(C)C1CCNC1 MCULE-7973729454 [0,0,0,0,1,0|3,0,0]=4 1991 B8R1.7 CN(C)[C@@H]1CCNC1 MCULE-5429405293 [0,0,0,0,1,0|3,0,0]=4 1992 B8R1.7 CN(C)[C@@H]1CCNC1 MCULE-5699517513 [0,0,0,0,1,0|3,0,0]=4 1993 B8R1.7 CN(C)[C@@H]1CCNC1 MCULE-7637416706 [0,0,0,0,1,0|3,0,0]=4 1994 B8R1.7 CN(C)[C@@H]1CCNC1 MCULE-8344052129 [0,0,0,0,1,0|3,0,0]=4 1995 B8R1.7 CN(C)[C@@H]1CCNC1 MCULE-9535121439 [0,0,0,0,1,0|3,0,0]=4 1996 B8R1.7 CN(C)[C@H]1CCNC1 MCULE-1584284196 [0,0,0,0,1,0|3,0,0]=4 1997 B8R1.7 CN(C)[C@H]1CCNC1 MCULE-2519823817 [0,0,0,0,1,0|3,0,0]=4 1998 B8R1.7 CN(C)[C@H]1CCNC1 MCULE-7209705136 [0,0,0,0,1,0|3,0,0]=4 1999 B8R1.7 CN(C)[C@H]1CCNC1 MCULE-9226971680 [0,0,0,0,1,0|3,0,0]=4 2000 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-2532670333 [0,0,0,0,1,0|2,0,1]=4 2001 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-7828853056 [0,0,0,0,1,0|2,0,1]=4 2002 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8150036197 [0,0,0,0,1,0|2,0,1]=4 2003 B8R1.7 C[C@@H](N)C1CCCC1 MCULE-8243361407 [0,0,0,0,1,0|2,0,1]=4 2004 B8R1.7 C[C@@H](O)C1CCCC1 MCULE-2530250478 [0,0,0,0,1,0|1,0,1]=3 2005 B8R1.7 C[C@@H](O)[C@H]1CCCO1 MCULE-6393902221 [0,0,0,0,1,0|2,0,1]=4 2006 B8R1.7 C[C@H](N)C1CCCC1 MCULE-4224874512 [0,0,0,0,1,0|2,0,1]=4 2007 B8R1.7 C[C@H](N)C1CCCC1 MCULE-6435654240 [0,0,0,0,1,0|2,0,1]=4 2008 B8R1.7 C[C@H](N)C1CCCC1 MCULE-8124130642 [0,0,0,0,1,0|2,0,1]=4 2009 B8R1.7 C[C@H](N)C1CCCC1 MCULE-9554309821 [0,0,0,0,1,0|2,0,1]=4 2010 B8R1.7 C[C@H](O)C1CCCC1 MCULE-9054245488 [0,0,0,0,1,0|1,0,1]=3 2011 B8R1.7 C[C@H](O)C1CCCO1 MCULE-5402066981 [0,0,0,0,1,0|2,0,1]=4 2012 B8R1.7 C[C@H](O)C1CCOC1 MCULE-9092941508 [0,0,0,0,1,0|2,0,1]=4 2013 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5014228849 [0,0,0,0,1,0|1,0,1]=3 2014 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5063876687 [0,0,0,0,1,0|1,0,1]=3 2015 B8R1.7 C[C@H](O)[C@@H]1CCCO1 MCULE-3917713920 [0,0,0,0,1,0|2,0,1]=4 2016 B8R1.7 FC(F)C1CCCN1 MCULE-2679624104 [0,0,0,0,1,0|2,0,1]=4 2017 B8R1.7 FC(F)C1CCCN1 MCULE-6665318434 [0,0,0,0,1,0|2,0,1]=4 2018 B8R1.7 FC(F)C1CCNC1 MCULE-5110001774 [0,0,0,0,1,0|2,0,1]=4 2019 B8R1.7 FC(F)C1CCNC1 MCULE-7392474545 [0,0,0,0,1,0|2,0,1]=4 2020 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-4550665710 [0,0,0,0,1,0|2,0,1]=4 2021 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-5404733637 [0,0,0,0,1,0|2,0,1]=4 2022 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-5465380229 [0,0,0,0,1,0|2,0,1]=4 2023 B8R1.7 FC(F)[C@@H]1CCCN1 MCULE-6799321789 [0,0,0,0,1,0|2,0,1]=4 2024 B8R1.7 FC(F)[C@@H]1CCNC1 MCULE-1389070219 [0,0,0,0,1,0|2,0,1]=4 2025 B8R1.7 FC(F)[C@@H]1CCNC1 MCULE-6256905199 [0,0,0,0,1,0|2,0,1]=4 2026 B8R1.7 FC(F)[C@@H]1CCNC1 MCULE-8299994889 [0,0,0,0,1,0|2,0,1]=4 2027 B8R1.7 FC(F)[C@@H]1CCNC1 MCULE-8670761679 [0,0,0,0,1,0|2,0,1]=4 2028 B8R1.7 FC(F)[C@H]1CCCN1 MCULE-5217394450 [0,0,0,0,1,0|2,0,1]=4 2029 B8R1.7 FC(F)[C@H]1CCCN1 MCULE-9580378678 [0,0,0,0,1,0|2,0,1]=4 2030 B8R1.7 FC(F)[C@H]1CCNC1 MCULE-2859952570 [0,0,0,0,1,0|2,0,1]=4 2031 B8R1.7 FC(F)[C@H]1CCNC1 MCULE-5049775388 [0,0,0,0,1,0|2,0,1]=4 2032 B8R1.7 FC(F)[C@H]1CCNC1 MCULE-5877891310 [0,0,0,0,1,0|2,0,1]=4 2033 B8R1.7 FC(F)[C@H]1CCNC1 MCULE-7811034691 [0,0,0,0,1,0|2,0,1]=4 2034 B8R1.7 N=C(N)C1CCCC1 MCULE-3526902612 [0,0,0,0,1,0|2,0,0]=3 2035 B8R1.7 N=C(N)C1CCCC1 MCULE-7613986881 [0,0,0,0,1,0|2,0,0]=3 2036 B8R1.7 N=C(N)C1CCCN1 MCULE-3357684433 [0,0,0,0,1,0|2,0,0]=3 2037 B8R1.7 N=C(N)C1CCCN1 MCULE-7506606085 [0,0,0,0,1,0|2,0,0]=3 2038 B8R1.7 N=C(N)C1CCCO1 MCULE-1348627071 [0,0,0,0,1,0|3,0,0]=4 2039 B8R1.7 N=C(N)C1CCCO1 MCULE-4359589378 [0,0,0,0,1,0|3,0,0]=4 2040 B8R1.7 N=C(N)C1CCOC1 MCULE-1442525298 [0,0,0,0,1,0|3,0,0]=4 2041 B8R1.7 N=C(N)C1CCOC1 MCULE-2289256622 [0,0,0,0,1,0|3,0,0]=4 2042 B8R1.7 N=C(N)C1CCOC1 MCULE-6644963466 [0,0,0,0,1,0|3,0,0]=4 2043 B8R1.7 N=C(N)N1CCCC1 MCULE-1081237301 [0,0,0,0,1,0|3,0,0]=4 2044 B8R1.7 N=C(N)N1CCCC1 MCULE-2310711826 [0,0,0,0,1,0|3,0,0]=4 2045 B8R1.7 N=C(N)N1CCCC1 MCULE-5860683743 [0,0,0,0,1,0|3,0,0]=4 2046 B8R1.7 N=C(N)N1CCCC1 MCULE-9334495491 [0,0,0,0,1,0|3,0,0]=4 2047 B8R1.7 NC(=O)C1=NCCN1 MCULE-8784849906 [0,0,0,0,1,0|2,0,1]=4 2048 B8R1.7 NC(=O)C1CC=CC1 MCULE-5556484257 [0,0,0,0,1,0|1,0,2]=4 2049 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [0,0,0,0,1,0|1,0,0]=2 2050 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [0,0,0,0,1,0|1,0,0]=2 2051 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [0,0,0,0,1,0|1,0,0]=2 2052 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [0,0,0,0,1,0|2,0,0]=3 2053 B8R1.7 NC(=O)C1CCNC1 MCULE-6035608651 [0,0,0,0,1,0|1,0,0]=2 2054 B8R1.7 NC(=O)C1CCNC1 MCULE-8602888952 [0,0,0,0,1,0|1,0,0]=2 2055 B8R1.7 NC(=O)C1CCOC1 MCULE-7120435380 [0,0,0,0,1,0|2,0,0]=3 2056 B8R1.7 NC(=O)C1CSCN1 MCULE-7557874523 [0,0,0,0,1,0|2,0,0]=3 2057 B8R1.7 NC(=O)N1CCCC1 MCULE-2282948234 [0,0,0,0,1,0|2,0,0]=3 2058 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-2894820708 [0,0,0,0,1,0|1,0,2]=4 2059 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-3478764941 [0,0,0,0,1,0|1,0,2]=4 2060 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-6696620969 [0,0,0,0,1,0|1,0,2]=4 2061 B8R1.7 NC(=O)[C@@H]1C=CCN1 MCULE-7629009072 [0,0,0,0,1,0|1,0,2]=4 2062 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [0,0,0,0,1,0|1,0,0]=2 2063 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [0,0,0,0,1,0|1,0,0]=2 2064 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [0,0,0,0,1,0|1,0,0]=2 2065 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [0,0,0,0,1,0|1,0,0]=2 2066 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [0,0,0,0,1,0|2,0,0]=3 2067 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [0,0,0,0,1,0|2,0,0]=3 2068 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1320057579 [0,0,0,0,1,0|1,0,0]=2 2069 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1678228480 [0,0,0,0,1,0|1,0,0]=2 2070 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-3340066069 [0,0,0,0,1,0|1,0,0]=2 2071 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-8833406496 [0,0,0,0,1,0|1,0,0]=2 2072 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [0,0,0,0,1,0|1,0,0]=2 2073 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [0,0,0,0,1,0|1,0,0]=2 2074 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [0,0,0,0,1,0|1,0,0]=2 2075 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [0,0,0,0,1,0|1,0,0]=2 2076 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-1673594093 [0,0,0,0,1,0|1,0,0]=2 2077 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-6725123306 [0,0,0,0,1,0|1,0,0]=2 2078 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-7222756259 [0,0,0,0,1,0|1,0,0]=2 2079 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-8100234071 [0,0,0,0,1,0|1,0,0]=2 2080 B8R1.7 NC(=O)[C@H]1CCOC1 MCULE-1231475693 [0,0,0,0,1,0|2,0,0]=3 2081 B8R1.7 NC(=S)C1CCCC1 MCULE-8081902896 [0,0,0,0,1,0|1,1,0]=3 2082 B8R1.7 NC(=S)C1CCCO1 MCULE-7906949480 [0,0,0,0,1,0|2,1,0]=4 2083 B8R1.7 NC(=S)C1CCNC1 MCULE-4169836111 [0,0,0,0,1,0|1,1,0]=3 2084 B8R1.7 NC(=S)C1CCOC1 MCULE-1942658620 [0,0,0,0,1,0|2,1,0]=4 2085 B8R1.7 NC(=S)N1CCCC1 MCULE-1483517657 [0,0,0,0,1,0|2,1,0]=4 2086 B8R1.7 O=C(Cl)C1CC=CC1 MCULE-8148758182 [0,0,0,0,1,0|1,0,2]=4 2087 B8R1.7 O=C(Cl)C1CCCC1 MCULE-1337538941 [0,0,0,0,1,0|1,0,0]=2 2088 B8R1.7 O=C(Cl)C1CCCO1 MCULE-9691919934 [0,0,0,0,1,0|2,0,0]=3 2089 B8R1.7 O=C(Cl)C1CCOC1 MCULE-9071234830 [0,0,0,0,1,0|2,0,0]=3 2090 B8R1.7 O=C(Cl)N1CCCC1 MCULE-2201729080 [0,0,0,0,1,0|2,0,0]=3 2091 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [0,0,0,0,1,0|0,0,2]=3 2092 B8R1.7 O=C(O)C1=CCCO1 MCULE-8380391200 [0,0,0,0,1,0|1,0,2]=4 2093 B8R1.7 O=C(O)C1=CCCS1 MCULE-9231409703 [0,0,0,0,1,0|1,0,2]=4 2094 B8R1.7 O=C(O)C1=CCNC1 MCULE-2391284266 [0,0,0,0,1,0|0,0,2]=3 2095 B8R1.7 O=C(O)C1=CCNC1 MCULE-5725335930 [0,0,0,0,1,0|0,0,2]=3 2096 B8R1.7 O=C(O)C1=CCOC1 MCULE-3209603870 [0,0,0,0,1,0|1,0,2]=4 2097 B8R1.7 O=C(O)C1=CCSC1 MCULE-3187835692 [0,0,0,0,1,0|1,0,2]=4 2098 B8R1.7 O=C(O)C1=COCC1 MCULE-7263072561 [0,0,0,0,1,0|1,0,2]=4 2099 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [0,0,0,0,1,0|0,0,2]=3 2100 B8R1.7 O=C(O)C1=NOCC1 MCULE-3126584315 [0,0,0,0,1,0|1,0,2]=4 2101 B8R1.7 O=C(O)C1C=CCC1 MCULE-8870546284 [0,0,0,0,1,0|0,0,2]=3 2102 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [0,0,0,0,1,0|0,0,2]=3 2103 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [0,0,0,0,1,0|0,0,2]=3 2104 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [0,0,0,0,1,0|0,0,2]=3 2105 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [0,0,0,0,1,0|0,0,2]=3 2106 B8R1.7 O=C(O)C1C=CCO1 MCULE-7417068170 [0,0,0,0,1,0|1,0,2]=4 2107 B8R1.7 O=C(O)C1CC=CC1 MCULE-7876630177 [0,0,0,0,1,0|0,0,2]=3 2108 B8R1.7 O=C(O)C1CCC=N1 MCULE-1792151957 [0,0,0,0,1,0|0,0,2]=3 2109 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [0,0,0,0,1,0|0,0,0]=1 2110 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [0,0,0,0,1,0|0,0,0]=1 2111 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [0,0,0,0,1,0|0,0,0]=1 2112 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [0,0,0,0,1,0|0,0,0]=1 2113 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [0,0,0,0,1,0|0,0,0]=1 2114 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [0,0,0,0,1,0|1,0,0]=2 2115 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [0,0,0,0,1,0|1,0,0]=2 2116 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [0,0,0,0,1,0|1,0,0]=2 2117 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [0,0,0,0,1,0|0,0,0]=1 2118 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [0,0,0,0,1,0|0,0,0]=1 2119 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [0,0,0,0,1,0|0,0,0]=1 2120 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [0,0,0,0,1,0|1,0,0]=2 2121 B8R1.7 O=C(O)C1CCSC1 MCULE-7898686734 [0,0,0,0,1,0|1,0,0]=2 2122 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [0,0,0,0,1,0|1,0,0]=2 2123 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [0,0,0,0,1,0|1,0,0]=2 2124 B8R1.7 O=C(O)C1CSCN1 MCULE-2391637686 [0,0,0,0,1,0|1,0,0]=2 2125 B8R1.7 O=C(O)C1CSCN1 MCULE-9622331370 [0,0,0,0,1,0|1,0,0]=2 2126 B8R1.7 O=C(O)C1CSSC1 MCULE-8231952386 [0,0,0,0,1,0|2,0,0]=3 2127 B8R1.7 O=C(O)C1NCCS1 MCULE-2504435743 [0,0,0,0,1,0|1,0,0]=2 2128 B8R1.7 O=C(O)C1SCCS1 MCULE-4466563646 [0,0,0,0,1,0|2,0,0]=3 2129 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [0,0,0,0,1,0|1,0,0]=2 2130 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [0,0,0,0,1,0|0,0,2]=3 2131 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [0,0,0,0,1,0|0,0,2]=3 2132 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [0,0,0,0,1,0|0,0,2]=3 2133 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [0,0,0,0,1,0|0,0,2]=3 2134 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [0,0,0,0,1,0|0,0,0]=1 2135 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [0,0,0,0,1,0|0,0,0]=1 2136 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [0,0,0,0,1,0|0,0,0]=1 2137 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [0,0,0,0,1,0|0,0,0]=1 2138 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [0,0,0,0,1,0|1,0,0]=2 2139 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [0,0,0,0,1,0|1,0,0]=2 2140 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [0,0,0,0,1,0|0,0,0]=1 2141 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [0,0,0,0,1,0|0,0,0]=1 2142 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [0,0,0,0,1,0|0,0,0]=1 2143 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [0,0,0,0,1,0|0,0,0]=1 2144 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [0,0,0,0,1,0|1,0,0]=2 2145 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [0,0,0,0,1,0|1,0,0]=2 2146 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [0,0,0,0,1,0|1,0,0]=2 2147 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [0,0,0,0,1,0|1,0,0]=2 2148 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [0,0,0,0,1,0|1,0,0]=2 2149 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [0,0,0,0,1,0|1,0,0]=2 2150 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-4243406881 [0,0,0,0,1,0|1,0,0]=2 2151 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-6343154165 [0,0,0,0,1,0|1,0,0]=2 2152 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [0,0,0,0,1,0|0,0,2]=3 2153 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [0,0,0,0,1,0|0,0,2]=3 2154 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [0,0,0,0,1,0|0,0,2]=3 2155 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [0,0,0,0,1,0|0,0,0]=1 2156 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [0,0,0,0,1,0|0,0,0]=1 2157 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [0,0,0,0,1,0|1,0,0]=2 2158 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [0,0,0,0,1,0|1,0,0]=2 2159 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [0,0,0,0,1,0|0,0,0]=1 2160 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [0,0,0,0,1,0|0,0,0]=1 2161 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [0,0,0,0,1,0|0,0,0]=1 2162 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [0,0,0,0,1,0|0,0,0]=1 2163 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [0,0,0,0,1,0|1,0,0]=2 2164 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [0,0,0,0,1,0|1,0,0]=2 2165 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-6095527710 [0,0,0,0,1,0|1,0,0]=2 2166 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-9117444908 [0,0,0,0,1,0|1,0,0]=2 2167 B8R1.7 O=C([O-])C1CCC=N1 MCULE-3235635441 [0,0,0,0,1,0|0,0,3]=4 2168 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [0,0,0,0,1,0|0,0,1]=2 2169 B8R1.7 O=C([O-])C1CSCN1 MCULE-9836043803 [0,0,0,0,1,0|1,0,1]=3 2170 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [0,0,0,0,1,0|0,0,1]=2 2171 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [0,0,0,0,1,0|0,0,1]=2 2172 B8R1.7 O=N(=O)C1CCCC1 MCULE-6499665829 [0,0,0,0,1,0|1,0,1]=3 2173 B8R1.7 O=S([O-])C1CCCC1 MCULE-4973639131 [0,0,0,0,1,0|1,0,1]=3 2174 B8R1.7 O=S([O-])C1CCCC1 MCULE-9227389818 [0,0,0,0,1,0|1,0,1]=3 2175 B8R1.7 O=S([O-])C1CCOC1 MCULE-2574399704 [0,0,0,0,1,0|2,0,1]=4 2176 B8R1.7 O=S([O-])C1CCOC1 MCULE-8651987419 [0,0,0,0,1,0|2,0,1]=4 2177 B8R1.7 OB(O)C1CCCC1 MCULE-7101191940 [0,0,0,0,1,0|1,0,1]=3 2178 B8R1.7 OB(O)C1CCCN1 MCULE-5123578937 [0,0,0,0,1,0|1,0,1]=3 2179 B8R1.7 OB(O)C1CCCN1 MCULE-6072524963 [0,0,0,0,1,0|1,0,1]=3 2180 B8R1.7 OB(O)C1CCOC1 MCULE-6097210028 [0,0,0,0,1,0|2,0,1]=4 2181 B8R1.7 S=C(S)N1CCCC1 MCULE-1085952223 [0,0,0,0,1,0|1,2,0]=4 2182 B8R1.7 S=C([S-])N1CCCC1 MCULE-9299211770 [0,0,0,0,1,0|1,2,0]=4 2183 B8R1.7 S=C([S-])N1CCCC1 MCULE-9637056918 [0,0,0,0,1,0|1,2,0]=4 2184 B8R1.7 [C@@H]1(CCNC1)C(C)C MCULE-4130251176 [0,0,0,0,1,0|2,0,1]=4 2185 B8R1.7 [C@@H]1(CCNC1)C(C)C MCULE-9716712888 [0,0,0,0,1,0|2,0,1]=4 2186 B8R1.7 [C@@H]1(CCNC1)N(C)C MCULE-7704345218 [0,0,0,0,1,0|3,0,0]=4 2187 B8R1.7 [C@@H]1(CSCN1)C(=O)[O-] MCULE-3895380806 [0,0,0,0,1,0|1,0,1]=3 2188 B8R1.7 [NH2+]=C(N)N1CCCC1 MCULE-9887365479 [0,0,0,0,1,0|3,0,0]=4 2189 B10R1.18 CC(=O)C=C1CCCCC1 MCULE-8551739363 [0,0,0,0,0,1|2,0,1]=4 2190 B10R1.18 CC(=O)CC1CCCCC1 MCULE-4557008527 [0,0,0,0,0,1|2,0,0]=3 2191 B10R1.18 CC(=O)CC1CCCCN1 MCULE-1827771795 [0,0,0,0,0,1|3,0,0]=4 2192 B10R1.18 CC(=O)CC1CCCCN1 MCULE-9317294757 [0,0,0,0,0,1|3,0,0]=4 2193 B10R1.18 CC(=O)CC1CCCCO1 MCULE-1058487646 [0,0,0,0,0,1|3,0,0]=4 2194 B10R1.18 CC(=O)CC1CCCOC1 MCULE-4781249046 [0,0,0,0,0,1|2,0,0]=3 2195 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3381787603 [0,0,0,0,0,1|3,0,0]=4 2196 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3485224360 [0,0,0,0,0,1|3,0,0]=4 2197 B10R1.18 CC(=O)CC1CCOCC1 MCULE-6845890561 [0,0,0,0,0,1|3,0,0]=4 2198 B10R1.18 CC(=O)CC1COCCN1 MCULE-5675632157 [0,0,0,0,0,1|3,0,0]=4 2199 B10R1.18 CC(=O)CC1COCCN1 MCULE-9995133275 [0,0,0,0,0,1|3,0,0]=4 2200 B10R1.18 CC(=O)CN1CCCCC1 MCULE-2519145455 [0,0,0,0,0,1|3,0,0]=4 2201 B10R1.18 CC(=O)CN1CCCCC1 MCULE-8358959341 [0,0,0,0,0,1|3,0,0]=4 2202 B10R1.18 CC(=O)C[C@H]1CCCCN1 MCULE-2330430389 [0,0,0,0,0,1|3,0,0]=4 2203 B10R1.18 CC(=O)NC1CCCCC1 MCULE-8353778142 [0,0,0,0,0,1|2,0,0]=3 2204 B10R1.18 CC(=O)NC1CCCNC1 MCULE-2923451430 [0,0,0,0,0,1|1,0,0]=2 2205 B10R1.18 CC(=O)NC1CCCNC1 MCULE-7850537912 [0,0,0,0,0,1|1,0,0]=2 2206 B10R1.18 CC(=O)NC1CCNCC1 MCULE-7572445106 [0,0,0,0,0,1|3,0,0]=4 2207 B10R1.18 CC(=O)NC1CCNCC1 MCULE-8162462660 [0,0,0,0,0,1|3,0,0]=4 2208 B10R1.18 CC(=O)NC1CCOCC1 MCULE-8194699174 [0,0,0,0,0,1|3,0,0]=4 2209 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-3102769783 [0,0,0,0,0,1|1,0,0]=2 2210 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-4313494103 [0,0,0,0,0,1|1,0,0]=2 2211 B10R1.18 CC(=O)N[C@H]1CC=CCC1 MCULE-6218263527 [0,0,0,0,0,1|2,0,1]=4 2212 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-1582624021 [0,0,0,0,0,1|1,0,0]=2 2213 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-7588247669 [0,0,0,0,0,1|1,0,0]=2 2214 B10R1.18 CC(=O)OC1C=CCCC1 MCULE-7559627891 [0,0,0,0,0,1|2,0,1]=4 2215 B10R1.18 CC(=O)OC1CCCCC1 MCULE-8221153491 [0,0,0,0,0,1|2,0,0]=3 2216 B10R1.18 CC(=O)OC1CCCCS1 MCULE-7999769363 [0,0,0,0,0,1|3,0,0]=4 2217 B10R1.18 CC(=O)OC1CCCNC1 MCULE-1733458491 [0,0,0,0,0,1|1,0,0]=2 2218 B10R1.18 CC(=O)OC1CCCNC1 MCULE-4433179343 [0,0,0,0,0,1|1,0,0]=2 2219 B10R1.18 CC(=O)OC1CCNCC1 MCULE-3223270695 [0,0,0,0,0,1|3,0,0]=4 2220 B10R1.18 CC(=O)OC1CCNCC1 MCULE-4522205472 [0,0,0,0,0,1|3,0,0]=4 2221 B10R1.18 CC(=O)OC1CCNCC1 MCULE-4714651381 [0,0,0,0,0,1|3,0,0]=4 2222 B10R1.18 CC(C)CC1CCCNC1 MCULE-3604764829 [0,0,0,0,0,1|2,0,1]=4 2223 B10R1.18 CC(C)CC1CCCNC1 MCULE-6586488336 [0,0,0,0,0,1|2,0,1]=4 2224 B10R1.18 CC(C)NC1CCCNC1 MCULE-1628072615 [0,0,0,0,0,1|2,0,1]=4 2225 B10R1.18 CC(C)NC1CCCNC1 MCULE-5576038917 [0,0,0,0,0,1|2,0,1]=4 2226 B10R1.18 CC(C)N[C@@H]1CCCNC1 MCULE-3323435797 [0,0,0,0,0,1|2,0,1]=4 2227 B10R1.18 CC(C)N[C@@H]1CCCNC1 MCULE-9076917958 [0,0,0,0,0,1|2,0,1]=4 2228 B10R1.18 CC(C)N[C@H]1CCCNC1 MCULE-6702825278 [0,0,0,0,0,1|2,0,1]=4 2229 B10R1.18 CC(C)N[C@H]1CCCNC1 MCULE-9796825487 [0,0,0,0,0,1|2,0,1]=4 2230 B10R1.18 CC(C)OC1CCCNC1 MCULE-3302964117 [0,0,0,0,0,1|2,0,1]=4 2231 B10R1.18 CC(C)OC1CCCNC1 MCULE-5832829991 [0,0,0,0,0,1|2,0,1]=4 2232 B10R1.18 CN(C)CC1CCCNC1 MCULE-4564539644 [0,0,0,0,0,1|3,0,0]=4 2233 B10R1.18 CN(C)CC1CCCNC1 MCULE-5532544629 [0,0,0,0,0,1|3,0,0]=4 2234 B10R1.18 C[C@@H](O)CC1CCCCC1 MCULE-4273662766 [0,0,0,0,0,1|2,0,1]=4 2235 B10R1.18 C[C@H](O)CC1CCCCC1 MCULE-7528064890 [0,0,0,0,0,1|2,0,1]=4 2236 B10R1.18 FC(F)CC1CCCNC1 MCULE-3839597255 [0,0,0,0,0,1|2,0,1]=4 2237 B10R1.18 FC(F)CC1CCCNC1 MCULE-7268432291 [0,0,0,0,0,1|2,0,1]=4 2238 B10R1.18 FC(F)OC1CCCNC1 MCULE-1915445424 [0,0,0,0,0,1|2,0,1]=4 2239 B10R1.18 FC(F)OC1CCCNC1 MCULE-4365167812 [0,0,0,0,0,1|2,0,1]=4 2240 B10R1.18 FC(F)OC1CCCNC1 MCULE-5963215719 [0,0,0,0,0,1|2,0,1]=4 2241 B10R1.18 FC(F)O[C@@H]1CCCNC1 MCULE-1705592115 [0,0,0,0,0,1|2,0,1]=4 2242 B10R1.18 FC(F)O[C@@H]1CCCNC1 MCULE-5083294836 [0,0,0,0,0,1|2,0,1]=4 2243 B10R1.18 FC(F)O[C@H]1CCCNC1 MCULE-8538176121 [0,0,0,0,0,1|2,0,1]=4 2244 B10R1.18 FC(F)O[C@H]1CCCNC1 MCULE-9151691744 [0,0,0,0,0,1|2,0,1]=4 2245 B10R1.18 N=C(N)CC1CCCCC1 MCULE-8473334050 [0,0,0,0,0,1|3,0,0]=4 2246 B10R1.18 N=C(N)CC1CCCCC1 MCULE-9393856468 [0,0,0,0,0,1|3,0,0]=4 2247 B10R1.18 N=C(N)NC1CCCCC1 MCULE-8462693519 [0,0,0,0,0,1|3,0,0]=4 2248 B10R1.18 N=C(N)SC1CCCCC1 MCULE-2002714434 [0,0,0,0,0,1|3,0,0]=4 2249 B10R1.18 N=C(N)SC1CCCCC1 MCULE-5487361105 [0,0,0,0,0,1|3,0,0]=4 2250 B10R1.18 NC(=NC1CCCCC1)N MCULE-8896892004 [0,0,0,0,0,1|3,0,0]=4 2251 B10R1.18 NC(=O)CC1CCCCC1 MCULE-4951525688 [0,0,0,0,0,1|2,0,0]=3 2252 B10R1.18 NC(=O)CC1CCCCN1 MCULE-2185479052 [0,0,0,0,0,1|3,0,0]=4 2253 B10R1.18 NC(=O)CC1CCCCN1 MCULE-4538477610 [0,0,0,0,0,1|3,0,0]=4 2254 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9261260462 [0,0,0,0,0,1|1,0,0]=2 2255 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9756580933 [0,0,0,0,0,1|1,0,0]=2 2256 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4391382932 [0,0,0,0,0,1|3,0,0]=4 2257 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4639158092 [0,0,0,0,0,1|3,0,0]=4 2258 B10R1.18 NC(=O)CC1CCOCC1 MCULE-6220113088 [0,0,0,0,0,1|3,0,0]=4 2259 B10R1.18 NC(=O)CC1CNCCO1 MCULE-2394638010 [0,0,0,0,0,1|2,0,0]=3 2260 B10R1.18 NC(=O)CC1COCCN1 MCULE-1907387140 [0,0,0,0,0,1|3,0,0]=4 2261 B10R1.18 NC(=O)CC1COCCN1 MCULE-6398693859 [0,0,0,0,0,1|3,0,0]=4 2262 B10R1.18 NC(=O)CN1CCCCC1 MCULE-5267943459 [0,0,0,0,0,1|3,0,0]=4 2263 B10R1.18 NC(=O)NC1CCCCC1 MCULE-8036346010 [0,0,0,0,0,1|2,0,0]=3 2264 B10R1.18 NC(=O)NC1CCCNC1 MCULE-6949169935 [0,0,0,0,0,1|1,0,0]=2 2265 B10R1.18 NC(=O)NC1CCCNC1 MCULE-7043674090 [0,0,0,0,0,1|1,0,0]=2 2266 B10R1.18 NC(=O)NC1CCNCC1 MCULE-6399383870 [0,0,0,0,0,1|3,0,0]=4 2267 B10R1.18 NC(=O)NC1CCNCC1 MCULE-6486575063 [0,0,0,0,0,1|3,0,0]=4 2268 B10R1.18 NC(=O)NC1CCOCC1 MCULE-4139742761 [0,0,0,0,0,1|3,0,0]=4 2269 B10R1.18 NC(=O)OC1CCCCC1 MCULE-3235010863 [0,0,0,0,0,1|2,0,0]=3 2270 B10R1.18 NC(=O)OC1CCOCC1 MCULE-5947388770 [0,0,0,0,0,1|3,0,0]=4 2271 B10R1.18 NC(=S)CC1CCCCC1 MCULE-2529176221 [0,0,0,0,0,1|2,1,0]=4 2272 B10R1.18 NC(=S)NC1CCCCC1 MCULE-3435819926 [0,0,0,0,0,1|2,1,0]=4 2273 B10R1.18 O=C(Cl)C=C1CCCCC1 MCULE-2919809771 [0,0,0,0,0,1|2,0,1]=4 2274 B10R1.18 O=C(Cl)CC1CCCCC1 MCULE-2220383860 [0,0,0,0,0,1|2,0,0]=3 2275 B10R1.18 O=C(Cl)CC1CCOCC1 MCULE-6068907888 [0,0,0,0,0,1|3,0,0]=4 2276 B10R1.18 O=C(Cl)OC1CCCCC1 MCULE-4011557961 [0,0,0,0,0,1|2,0,0]=3 2277 B10R1.18 O=C(Cl)OC1CCOCC1 MCULE-5361190443 [0,0,0,0,0,1|3,0,0]=4 2278 B10R1.18 O=C(O)C=C1CCCCC1 MCULE-2830279446 [0,0,0,0,0,1|1,0,1]=3 2279 B10R1.18 O=C(O)C=C1CCNCC1 MCULE-2946232230 [0,0,0,0,0,1|2,0,1]=4 2280 B10R1.18 O=C(O)C=C1CCNCC1 MCULE-9183556093 [0,0,0,0,0,1|2,0,1]=4 2281 B10R1.18 O=C(O)C=C1CCOCC1 MCULE-2596143817 [0,0,0,0,0,1|2,0,1]=4 2282 B10R1.18 O=C(O)C=C1CCSCC1 MCULE-3222993494 [0,0,0,0,0,1|2,0,1]=4 2283 B10R1.18 O=C(O)CC1=CCCCC1 MCULE-9909477927 [0,0,0,0,0,1|1,0,2]=4 2284 B10R1.18 O=C(O)CC1C=CCCC1 MCULE-3207533436 [0,0,0,0,0,1|1,0,1]=3 2285 B10R1.18 O=C(O)CC1CC=CCC1 MCULE-3427584067 [0,0,0,0,0,1|1,0,1]=3 2286 B10R1.18 O=C(O)CC1CCCCC1 MCULE-3370925166 [0,0,0,0,0,1|1,0,0]=2 2287 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7593127940 [0,0,0,0,0,1|2,0,0]=3 2288 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7653711252 [0,0,0,0,0,1|2,0,0]=3 2289 B10R1.18 O=C(O)CC1CCCCO1 MCULE-2711682647 [0,0,0,0,0,1|2,0,0]=3 2290 B10R1.18 O=C(O)CC1CCCNC1 MCULE-3254470591 [0,0,0,0,0,1|0,0,0]=1 2291 B10R1.18 O=C(O)CC1CCCNC1 MCULE-7958803985 [0,0,0,0,0,1|0,0,0]=1 2292 B10R1.18 O=C(O)CC1CCCOC1 MCULE-5877605158 [0,0,0,0,0,1|1,0,0]=2 2293 B10R1.18 O=C(O)CC1CCNCC1 MCULE-1130327966 [0,0,0,0,0,1|2,0,0]=3 2294 B10R1.18 O=C(O)CC1CCNCC1 MCULE-2100213856 [0,0,0,0,0,1|2,0,0]=3 2295 B10R1.18 O=C(O)CC1CCOCC1 MCULE-7878329119 [0,0,0,0,0,1|2,0,0]=3 2296 B10R1.18 O=C(O)CC1CCSCC1 MCULE-3567762107 [0,0,0,0,0,1|2,0,0]=3 2297 B10R1.18 O=C(O)CC1CNCCN1 MCULE-5141588986 [0,0,0,0,0,1|1,0,0]=2 2298 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3058504133 [0,0,0,0,0,1|1,0,0]=2 2299 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3387061328 [0,0,0,0,0,1|1,0,0]=2 2300 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4327756750 [0,0,0,0,0,1|1,0,0]=2 2301 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4883251317 [0,0,0,0,0,1|1,0,0]=2 2302 B10R1.18 O=C(O)CC1COCCN1 MCULE-4486190659 [0,0,0,0,0,1|2,0,0]=3 2303 B10R1.18 O=C(O)CC1COCCN1 MCULE-8010316572 [0,0,0,0,0,1|2,0,0]=3 2304 B10R1.18 O=C(O)CC1COCCO1 MCULE-8632741098 [0,0,0,0,0,1|2,0,0]=3 2305 B10R1.18 O=C(O)CC1CSCCS1 MCULE-4793456872 [0,0,0,0,0,1|2,0,0]=3 2306 B10R1.18 O=C(O)CC1OCCCO1 MCULE-1471723881 [0,0,0,0,0,1|3,0,0]=4 2307 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9137136186 [0,0,0,0,0,1|2,0,0]=3 2308 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9769416161 [0,0,0,0,0,1|2,0,0]=3 2309 B10R1.18 O=C(O)CN1CCNCC1 MCULE-4945447446 [0,0,0,0,0,1|3,0,0]=4 2310 B10R1.18 O=C(O)CN1CCNCC1 MCULE-6990903527 [0,0,0,0,0,1|3,0,0]=4 2311 B10R1.18 O=C(O)CN1CCNCC1 MCULE-8811795576 [0,0,0,0,0,1|3,0,0]=4 2312 B10R1.18 O=C(O)CN1CCOCC1 MCULE-2955270234 [0,0,0,0,0,1|3,0,0]=4 2313 B10R1.18 O=C(O)CN1CCOCC1 MCULE-5710414541 [0,0,0,0,0,1|3,0,0]=4 2314 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9107067895 [0,0,0,0,0,1|3,0,0]=4 2315 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9299535292 [0,0,0,0,0,1|3,0,0]=4 2316 B10R1.18 O=C(O)C[C@@H]1CC=CCC1 MCULE-6316447839 [0,0,0,0,0,1|1,0,1]=3 2317 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-3905830299 [0,0,0,0,0,1|2,0,0]=3 2318 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-5277218457 [0,0,0,0,0,1|2,0,0]=3 2319 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-7510387772 [0,0,0,0,0,1|2,0,0]=3 2320 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-5325818659 [0,0,0,0,0,1|0,0,0]=1 2321 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-7001078313 [0,0,0,0,0,1|0,0,0]=1 2322 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-8120215253 [0,0,0,0,0,1|0,0,0]=1 2323 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-9602652995 [0,0,0,0,0,1|0,0,0]=1 2324 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4498530905 [0,0,0,0,0,1|1,0,0]=2 2325 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4549445854 [0,0,0,0,0,1|1,0,0]=2 2326 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-5055136882 [0,0,0,0,0,1|1,0,0]=2 2327 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-7244079860 [0,0,0,0,0,1|1,0,0]=2 2328 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-2046760558 [0,0,0,0,0,1|2,0,0]=3 2329 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-4473145834 [0,0,0,0,0,1|2,0,0]=3 2330 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-5100169676 [0,0,0,0,0,1|2,0,0]=3 2331 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-3680996115 [0,0,0,0,0,1|2,0,0]=3 2332 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-4674662417 [0,0,0,0,0,1|2,0,0]=3 2333 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-1302740697 [0,0,0,0,0,1|0,0,0]=1 2334 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-2509529219 [0,0,0,0,0,1|0,0,0]=1 2335 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-3753473259 [0,0,0,0,0,1|0,0,0]=1 2336 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-9619904988 [0,0,0,0,0,1|0,0,0]=1 2337 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-1832902178 [0,0,0,0,0,1|1,0,0]=2 2338 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5015018730 [0,0,0,0,0,1|1,0,0]=2 2339 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5838446318 [0,0,0,0,0,1|1,0,0]=2 2340 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-9119322865 [0,0,0,0,0,1|1,0,0]=2 2341 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-8571286067 [0,0,0,0,0,1|2,0,0]=3 2342 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-9555376320 [0,0,0,0,0,1|2,0,0]=3 2343 B10R1.18 O=C(O)NC1CCCCC1 MCULE-5645794848 [0,0,0,0,0,1|1,0,0]=2 2344 B10R1.18 O=P(O)CN1CCCCC1 MCULE-5899780033 [0,0,0,0,0,1|3,0,0]=4 2345 B10R1.18 OB(O)CC1CCCCC1 MCULE-6141319242 [0,0,0,0,0,1|2,0,1]=4 2346 B10R1.18 S=C([S-])NC1CCCCC1 MCULE-2536624531 [0,0,0,0,0,1|1,2,0]=4 2347 B10R1.18 S=C([S-])NC1CCCCC1 MCULE-3227944350 [0,0,0,0,0,1|1,2,0]=4 2348 B10R1.348 CC(=O)C1CCCCCC1 MCULE-9324503120 [0,0,0,0,0,1|2,0,0]=3 2349 B10R1.348 CC(=O)N1CCCCCC1 MCULE-4232660324 [0,0,0,0,0,1|3,0,0]=4 2350 B10R1.348 CC(=O)N1CCCNCC1 MCULE-1264485184 [0,0,0,0,0,1|2,0,0]=3 2351 B10R1.348 CC(=O)N1CCCNCC1 MCULE-8835178311 [0,0,0,0,0,1|2,0,0]=3 2352 B10R1.348 CC(C)C1CCCNCC1 MCULE-5540544521 [0,0,0,0,0,1|2,0,1]=4 2353 B10R1.348 CC(C)C1CNCCCO1 MCULE-8475673405 [0,0,0,0,0,1|2,0,1]=4 2354 B10R1.348 CC(O)C1CCCCCC1 MCULE-6112396200 [0,0,0,0,0,1|2,0,1]=4 2355 B10R1.348 CN(C)C1CCCCNC1 MCULE-8146255234 [0,0,0,0,0,1|3,0,0]=4 2356 B10R1.348 CN(C)C1CCCNCC1 MCULE-8264700976 [0,0,0,0,0,1|3,0,0]=4 2357 B10R1.348 CN(C)C1CCCNCC1 MCULE-9138328347 [0,0,0,0,0,1|3,0,0]=4 2358 B10R1.348 CN(C)[C@H]1CCCCNC1 MCULE-2937664740 [0,0,0,0,0,1|3,0,0]=4 2359 B10R1.348 CN(C)[C@H]1CCCCNC1 MCULE-4770968804 [0,0,0,0,0,1|3,0,0]=4 2360 B10R1.348 C[C@@H](O)C1CCCCCC1 MCULE-7903519728 [0,0,0,0,0,1|2,0,1]=4 2361 B10R1.348 C[C@H](O)C1CCCCCC1 MCULE-5041888426 [0,0,0,0,0,1|2,0,1]=4 2362 B10R1.348 N=C(N)C1CCCCCC1 MCULE-2361950713 [0,0,0,0,0,1|3,0,0]=4 2363 B10R1.348 N=C(N)C1CCCCCC1 MCULE-8756683037 [0,0,0,0,0,1|3,0,0]=4 2364 B10R1.348 NC(=O)C1CCCCCC1 MCULE-2005648941 [0,0,0,0,0,1|2,0,0]=3 2365 B10R1.348 NC(=O)C1CCCCNC1 MCULE-6748059498 [0,0,0,0,0,1|1,0,0]=2 2366 B10R1.348 NC(=O)C1CCCCNC1 MCULE-8697140088 [0,0,0,0,0,1|1,0,0]=2 2367 B10R1.348 NC(=O)C1CNCCOC1 MCULE-3555049909 [0,0,0,0,0,1|1,0,0]=2 2368 B10R1.348 NC(=O)N1CCCCCC1 MCULE-6181473782 [0,0,0,0,0,1|3,0,0]=4 2369 B10R1.348 NC(=O)N1CCCNCC1 MCULE-1958255797 [0,0,0,0,0,1|2,0,0]=3 2370 B10R1.348 O=C(Cl)C1CCCCCC1 MCULE-4659434885 [0,0,0,0,0,1|2,0,0]=3 2371 B10R1.348 O=C(Cl)N1CCCCCC1 MCULE-3861437886 [0,0,0,0,0,1|3,0,0]=4 2372 B10R1.348 O=C(O)C1=CCCCCC1 MCULE-5438079704 [0,0,0,0,0,1|1,0,1]=3 2373 B10R1.348 O=C(O)C1=CCCOCC1 MCULE-6315041103 [0,0,0,0,0,1|1,0,2]=4 2374 B10R1.348 O=C(O)C1CCC=CCC1 MCULE-6767000432 [0,0,0,0,0,1|1,0,1]=3 2375 B10R1.348 O=C(O)C1CCCCCC1 MCULE-7903672891 [0,0,0,0,0,1|1,0,0]=2 2376 B10R1.348 O=C(O)C1CCCCCN1 MCULE-2741684183 [0,0,0,0,0,1|1,0,0]=2 2377 B10R1.348 O=C(O)C1CCCCCN1 MCULE-7374703751 [0,0,0,0,0,1|1,0,0]=2 2378 B10R1.348 O=C(O)C1CCCCNC1 MCULE-3392190626 [0,0,0,0,0,1|0,0,0]=1 2379 B10R1.348 O=C(O)C1CCCCNC1 MCULE-7795043703 [0,0,0,0,0,1|0,0,0]=1 2380 B10R1.348 O=C(O)C1CCCNCC1 MCULE-7690110773 [0,0,0,0,0,1|0,0,0]=1 2381 B10R1.348 O=C(O)C1CCCNCC1 MCULE-9766781803 [0,0,0,0,0,1|0,0,0]=1 2382 B10R1.348 O=C(O)C1CCCOCC1 MCULE-9318516869 [0,0,0,0,0,1|1,0,0]=2 2383 B10R1.348 O=C(O)C1CNCCCN1 MCULE-3558230210 [0,0,0,0,0,1|0,0,0]=1 2384 B10R1.348 O=C(O)C1CNCCCN1 MCULE-6835715048 [0,0,0,0,0,1|0,0,0]=1 2385 B10R1.348 O=C(O)C1CNCCCO1 MCULE-2282415374 [0,0,0,0,0,1|0,0,0]=1 2386 B10R1.348 O=C(O)C1CNCCCO1 MCULE-3064687044 [0,0,0,0,0,1|0,0,0]=1 2387 B10R1.348 O=C(O)C1COCCOC1 MCULE-7686530449 [0,0,0,0,0,1|1,0,0]=2 2388 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2016813857 [0,0,0,0,0,1|1,0,0]=2 2389 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2504826586 [0,0,0,0,0,1|1,0,0]=2 2390 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-4939523441 [0,0,0,0,0,1|1,0,0]=2 2391 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-8497154031 [0,0,0,0,0,1|1,0,0]=2 2392 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-1709248067 [0,0,0,0,0,1|1,0,0]=2 2393 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4607599990 [0,0,0,0,0,1|1,0,0]=2 2394 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4947785395 [0,0,0,0,0,1|1,0,0]=2 2395 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-8502245212 [0,0,0,0,0,1|1,0,0]=2 2396 B10R1.348 O=C(O)[C@H]1CCCNCC1 MCULE-2658567129 [0,0,0,0,0,1|0,0,0]=1 2397 B7R0.1 C#CCCCCC=O MCULE-2019630243 [1,0,1,0,0,0|1,0,1]=4 2398 B7R0.1 C=CCCCCC=O MCULE-6786275827 [1,0,1,0,0,0|1,0,1]=4 2399 B7R0.1 C=CCCCCCC MCULE-6867393536 [1,0,1,0,0,0|2,0,0]=4 2400 B7R0.1 C=CCCCCNC MCULE-3676018759 [1,0,1,0,0,0|1,0,0]=3 2401 B7R0.1 C=CCCCCNC MCULE-9443600983 [1,0,1,0,0,0|1,0,0]=3 2402 B7R0.1 C=CCCNCCO MCULE-8357008337 [1,0,1,0,0,0|2,0,0]=4 2403 B7R0.1 CC#CCCCC=O MCULE-9621727341 [1,0,1,0,0,0|1,0,1]=4 2404 B7R0.1 CC/C=C\CCC=O MCULE-5862165111 [1,0,1,0,0,0|1,0,1]=4 2405 B7R0.1 CCC=CCCC=O MCULE-1386777548 [1,0,1,0,0,0|1,0,1]=4 2406 B7R0.1 CCCCCCC=O MCULE-5251820425 [1,0,1,0,0,0|1,0,0]=3 2407 B7R0.1 CCCCCCCO MCULE-5882959353 [1,0,1,0,0,0|1,0,1]=4 2408 B7R0.1 CCCCCCNC MCULE-1828296852 [1,0,1,0,0,0|1,0,1]=4 2409 B7R0.1 CCCCCCNO MCULE-4175875706 [1,0,1,0,0,0|2,0,0]=4 2410 B7R0.1 CCCCCCNO MCULE-8719557426 [1,0,1,0,0,0|2,0,0]=4 2411 B7R0.1 CCCCCOC=O MCULE-2718009140 [1,0,1,0,0,0|2,0,0]=4 2412 B7R0.1 CCCCNCCC MCULE-6342731867 [1,0,1,0,0,0|1,0,1]=4 2413 B7R0.1 CCCNCCC#N MCULE-4350757262 [1,0,1,0,0,0|1,0,1]=4 2414 B7R0.1 CCCNCCCN MCULE-6668094176 [1,0,1,0,0,0|1,0,1]=4 2415 B7R0.1 CCCNCCCO MCULE-4366982860 [1,0,1,0,0,0|0,0,1]=3 2416 B7R0.1 CCCNCCNC MCULE-3857593384 [1,0,1,0,0,0|2,0,0]=4 2417 B7R0.1 CCCNCCOC MCULE-4425567647 [1,0,1,0,0,0|2,0,0]=4 2418 B7R0.1 CNCCCCCN MCULE-8023367999 [1,0,1,0,0,0|1,0,1]=4 2419 B7R0.1 CNCCCCCO MCULE-2988249730 [1,0,1,0,0,0|0,0,1]=3 2420 B7R0.1 CNCCCCCO MCULE-8033733525 [1,0,1,0,0,0|0,0,1]=3 2421 B7R0.1 CNCCCCNC MCULE-4466243376 [1,0,1,0,0,0|2,0,0]=4 2422 B7R0.1 CNCCCCOC MCULE-3203262011 [1,0,1,0,0,0|2,0,0]=4 2423 B7R0.1 CNCCOCCO MCULE-7869540361 [1,0,1,0,0,0|1,0,1]=4 2424 B7R0.1 COCCCCCO MCULE-6003118644 [1,0,1,0,0,0|1,0,1]=4 2425 B7R0.1 COCCOCC=O MCULE-2621317944 [1,0,1,0,0,0|2,0,0]=4 2426 B7R0.1 COCOCCC=O MCULE-3632276453 [1,0,1,0,0,0|2,0,0]=4 2427 B7R0.1 CSCCCCCO MCULE-3422729293 [1,0,1,0,0,0|1,0,1]=4 2428 B7R0.1 NCCNCCCO MCULE-6476789217 [1,0,1,0,0,0|1,0,1]=4 2429 B7R0.1 O=CCCCCC=O MCULE-3751145550 [1,0,1,0,0,0|2,0,0]=4 2430 B7R0.1 O=CCCCCCBr MCULE-7014516847 [1,0,1,0,0,0|2,0,0]=4 2431 B7R0.1 O=CCCCCCCl MCULE-8269912560 [1,0,1,0,0,0|2,0,0]=4 2432 B7R0.1 O=CCCCCCF MCULE-8174281286 [1,0,1,0,0,0|2,0,0]=4 2433 B7R0.1 O=CCCCCCO MCULE-3978349845 [1,0,1,0,0,0|2,0,0]=4 2434 B7R0.1 O=CCCCCCO MCULE-4997016680 [1,0,1,0,0,0|2,0,0]=4 2435 B7R0.1 OCCCNCCO MCULE-1959450493 [1,0,1,0,0,0|1,0,1]=4 2436 B7R0.4 C#CCCCC(=O)O MCULE-7464892335 [1,0,1,0,0,0|0,0,2]=4 2437 B7R0.4 C#CCNCC(=O)O MCULE-3308171795 [1,0,1,0,0,0|0,0,2]=4 2438 B7R0.4 C#CCNCC(=O)O MCULE-7200045848 [1,0,1,0,0,0|0,0,2]=4 2439 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [1,0,1,0,0,0|0,0,2]=4 2440 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [1,0,1,0,0,0|0,0,2]=4 2441 B7R0.4 C=C(Br)CCCCC MCULE-3049831354 [1,0,1,0,0,0|2,0,0]=4 2442 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [1,0,1,0,0,0|2,0,0]=4 2443 B7R0.4 C=C(Cl)CCCCC MCULE-5074452982 [1,0,1,0,0,0|2,0,0]=4 2444 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [1,0,1,0,0,0|0,0,2]=4 2445 B7R0.4 C=CCNCC(=O)O MCULE-2925626447 [1,0,1,0,0,0|0,0,2]=4 2446 B7R0.4 C=CCNCC(=O)O MCULE-6980667867 [1,0,1,0,0,0|0,0,2]=4 2447 B7R0.4 CC#CCCC(=O)O MCULE-1415388780 [1,0,1,0,0,0|0,0,2]=4 2448 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [1,0,1,0,0,0|2,0,0]=4 2449 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [1,0,1,0,0,0|2,0,0]=4 2450 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [1,0,1,0,0,0|2,0,0]=4 2451 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [1,0,1,0,0,0|2,0,0]=4 2452 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [1,0,1,0,0,0|2,0,0]=4 2453 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [1,0,1,0,0,0|0,0,2]=4 2454 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [1,0,1,0,0,0|0,0,2]=4 2455 B7R0.4 CCCC#CC(=O)O MCULE-1682387091 [1,0,1,0,0,0|0,0,2]=4 2456 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [1,0,1,0,0,0|0,0,2]=4 2457 B7R0.4 CCCCCB(O)O MCULE-3441747739 [1,0,1,0,0,0|1,0,1]=4 2458 B7R0.4 CCCCCC(=N)N MCULE-4874167268 [1,0,1,0,0,0|2,0,0]=4 2459 B7R0.4 CCCCCC(=N)N MCULE-6942690708 [1,0,1,0,0,0|2,0,0]=4 2460 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [1,0,1,0,0,0|1,0,0]=3 2461 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [1,0,1,0,0,0|1,0,0]=3 2462 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [1,0,1,0,0,0|1,0,0]=3 2463 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [1,0,1,0,0,0|0,0,0]=2 2464 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [1,0,1,0,0,0|0,0,1]=3 2465 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [1,0,1,0,0,0|0,0,1]=3 2466 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [1,0,1,0,0,0|1,1,0]=4 2467 B7R0.4 CCCCCC(C)O MCULE-2463855771 [1,0,1,0,0,0|1,0,1]=4 2468 B7R0.4 CCCCCN(=O)=O MCULE-6853489453 [1,0,1,0,0,0|1,0,1]=4 2469 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [1,0,1,0,0,0|1,0,1]=4 2470 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [1,0,1,0,0,0|1,0,1]=4 2471 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [1,0,1,0,0,0|1,0,1]=4 2472 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [1,0,1,0,0,0|1,0,1]=4 2473 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [1,0,1,0,0,0|2,0,0]=4 2474 B7R0.4 CCCCNC(=O)Cl MCULE-2148016012 [1,0,1,0,0,0|2,0,0]=4 2475 B7R0.4 CCCCNC(=O)N MCULE-3263036294 [1,0,1,0,0,0|2,0,0]=4 2476 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [1,0,1,0,0,0|2,0,0]=4 2477 B7R0.4 CCCCOC(=O)Cl MCULE-5750652482 [1,0,1,0,0,0|2,0,0]=4 2478 B7R0.4 CCCCOC(=O)N MCULE-7719579696 [1,0,1,0,0,0|2,0,0]=4 2479 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [1,0,1,0,0,0|2,0,0]=4 2480 B7R0.4 CCCCSC(=O)Cl MCULE-8008254909 [1,0,1,0,0,0|2,0,0]=4 2481 B7R0.4 CCCNCC(=O)N MCULE-2330202708 [1,0,1,0,0,0|1,0,0]=3 2482 B7R0.4 CCCNCC(=O)N MCULE-3731054780 [1,0,1,0,0,0|1,0,0]=3 2483 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [1,0,1,0,0,0|0,0,0]=2 2484 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [1,0,1,0,0,0|0,0,0]=2 2485 B7R0.4 CCCNCC(C)O MCULE-8110237473 [1,0,1,0,0,0|1,0,1]=4 2486 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [1,0,1,0,0,0|1,0,0]=3 2487 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [1,0,1,0,0,0|2,0,0]=4 2488 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [1,0,1,0,0,0|1,0,0]=3 2489 B7R0.4 CCNCCC(=O)N MCULE-4857735433 [1,0,1,0,0,0|1,0,0]=3 2490 B7R0.4 CCNCCC(=O)N MCULE-8238114591 [1,0,1,0,0,0|1,0,0]=3 2491 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [1,0,1,0,0,0|0,0,0]=2 2492 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [1,0,1,0,0,0|0,0,0]=2 2493 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [1,0,1,0,0,0|2,0,0]=4 2494 B7R0.4 CCOCCC(=O)Cl MCULE-8299617790 [1,0,1,0,0,0|2,0,0]=4 2495 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [1,0,1,0,0,0|1,0,0]=3 2496 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [1,0,1,0,0,0|1,0,0]=3 2497 B7R0.4 CNCCCC(=O)N MCULE-8337447772 [1,0,1,0,0,0|1,0,0]=3 2498 B7R0.4 CNCCCC(=O)N MCULE-9037809827 [1,0,1,0,0,0|1,0,0]=3 2499 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [1,0,1,0,0,0|0,0,0]=2 2500 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [1,0,1,0,0,0|0,0,0]=2 2501 B7R0.4 CNCCNC(=O)C MCULE-5361712613 [1,0,1,0,0,0|2,0,0]=4 2502 B7R0.4 CNCCNC(=O)C MCULE-9798024696 [1,0,1,0,0,0|2,0,0]=4 2503 B7R0.4 CNCCOC(=O)C MCULE-1850077864 [1,0,1,0,0,0|2,0,0]=4 2504 B7R0.4 CNCCOC(=O)C MCULE-7023987942 [1,0,1,0,0,0|2,0,0]=4 2505 B7R0.4 COCCCC(=O)C MCULE-3606369396 [1,0,1,0,0,0|2,0,0]=4 2506 B7R0.4 COCCCC(=O)O MCULE-3165881573 [1,0,1,0,0,0|1,0,0]=3 2507 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [1,0,1,0,0,0|1,0,0]=3 2508 B7R0.4 CSSCCC(=O)O MCULE-6571821309 [1,0,1,0,0,0|2,0,0]=4 2509 B7R0.4 N#CCCCC(=O)O MCULE-9921837071 [1,0,1,0,0,0|0,0,2]=4 2510 B7R0.4 NC(=O)CCCCBr MCULE-4949681497 [1,0,1,0,0,0|2,0,0]=4 2511 B7R0.4 NC(=O)CCCCCl MCULE-7937142112 [1,0,1,0,0,0|2,0,0]=4 2512 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [1,0,1,0,0,0|2,0,0]=4 2513 B7R0.4 NCCCCC(=O)N MCULE-3198962228 [1,0,1,0,0,0|1,0,0]=3 2514 B7R0.4 NCCCCC(=O)N MCULE-7986221705 [1,0,1,0,0,0|1,0,0]=3 2515 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [1,0,1,0,0,0|0,0,0]=2 2516 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [1,0,1,0,0,0|0,0,0]=2 2517 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [1,0,1,0,0,0|0,0,0]=2 2518 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [1,0,1,0,0,0|0,0,0]=2 2519 B7R0.4 NCCCNC(=O)N MCULE-1109440921 [1,0,1,0,0,0|2,0,0]=4 2520 B7R0.4 NCCCNC(=O)N MCULE-3933221897 [1,0,1,0,0,0|2,0,0]=4 2521 B7R0.4 NCCCOS(=O)O MCULE-8389295774 [1,0,1,0,0,0|2,0,0]=4 2522 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [1,0,1,0,0,0|1,0,0]=3 2523 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [1,0,1,0,0,0|1,0,0]=3 2524 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [1,0,1,0,0,0|1,0,0]=3 2525 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [1,0,1,0,0,0|1,0,0]=3 2526 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [1,0,1,0,0,0|1,0,0]=3 2527 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [1,0,1,0,0,0|1,0,0]=3 2528 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [1,0,1,0,0,0|1,0,0]=3 2529 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [1,0,1,0,0,0|1,0,0]=3 2530 B7R0.4 O=C(Cl)CCCCBr MCULE-5574450546 [1,0,1,0,0,0|2,0,0]=4 2531 B7R0.4 O=C(Cl)CCCCCl MCULE-9605707894 [1,0,1,0,0,0|2,0,0]=4 2532 B7R0.4 O=C(Cl)CCCCF MCULE-8110878511 [1,0,1,0,0,0|2,0,0]=4 2533 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [1,0,1,0,0,0|1,0,0]=3 2534 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [1,0,1,0,0,0|1,0,0]=3 2535 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [1,0,1,0,0,0|1,0,0]=3 2536 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [1,0,1,0,0,0|1,0,0]=3 2537 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [1,0,1,0,0,0|1,0,0]=3 2538 B7R0.4 O=C(O)COCCBr MCULE-4593325557 [1,0,1,0,0,0|2,0,0]=4 2539 B7R0.4 O=C(O)COCCCl MCULE-2978816248 [1,0,1,0,0,0|2,0,0]=4 2540 B7R0.4 O=C(O)COCCF MCULE-9820799514 [1,0,1,0,0,0|2,0,0]=4 2541 B7R0.4 O=C(O)COCCO MCULE-8297137880 [1,0,1,0,0,0|2,0,0]=4 2542 B7R0.4 O=C(O)CSCCCl MCULE-5204967583 [1,0,1,0,0,0|2,0,0]=4 2543 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [1,0,1,0,0,0|2,0,0]=4 2544 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [1,0,1,0,0,0|1,0,1]=4 2545 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [1,0,1,0,0,0|1,0,1]=4 2546 B7R0.3 CC(C=O)CCC#N MCULE-6355316754 [1,0,1,0,0,0|0,0,2]=4 2547 B7R0.3 CC(CN)CCCN MCULE-1249275042 [1,0,1,0,0,0|1,0,1]=4 2548 B7R0.3 CC(CO)CCCO MCULE-8589885622 [1,0,1,0,0,0|1,0,1]=4 2549 B7R0.3 CCCCC(Cl)C=O MCULE-7474969991 [1,0,1,0,0,0|2,0,0]=4 2550 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [1,0,1,0,0,0|1,0,0]=3 2551 B7R0.3 CCNCC(C)C#N MCULE-5920854475 [1,0,1,0,0,0|1,0,1]=4 2552 B7R0.3 CCNCC(C)CC MCULE-8768620428 [1,0,1,0,0,0|1,0,1]=4 2553 B7R0.3 CCNCC(C)CC MCULE-9491990692 [1,0,1,0,0,0|1,0,1]=4 2554 B7R0.3 CCNCC(C)OC MCULE-9115511555 [1,0,1,0,0,0|2,0,0]=4 2555 B7R0.3 CCOCC(C)CO MCULE-6831759423 [1,0,1,0,0,0|1,0,1]=4 2556 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [1,0,1,0,0,0|0,0,2]=4 2557 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [1,0,1,0,0,0|0,0,2]=4 2558 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [1,0,1,0,0,0|0,0,2]=4 2559 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [1,0,1,0,0,0|0,0,2]=4 2560 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [1,0,1,0,0,0|0,0,2]=4 2561 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [1,0,1,0,0,0|0,0,2]=4 2562 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [1,0,1,0,0,0|0,0,2]=4 2563 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [1,0,1,0,0,0|0,0,2]=4 2564 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [1,0,1,0,0,0|0,0,2]=4 2565 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [1,0,1,0,0,0|0,0,2]=4 2566 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [1,0,1,0,0,0|0,0,2]=4 2567 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [1,0,1,0,0,0|0,0,2]=4 2568 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [1,0,1,0,0,0|0,0,2]=4 2569 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [1,0,1,0,0,0|0,0,2]=4 2570 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [1,0,1,0,0,0|0,0,2]=4 2571 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [1,0,1,0,0,0|0,0,2]=4 2572 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [1,0,1,0,0,0|0,0,2]=4 2573 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [1,0,1,0,0,0|0,0,2]=4 2574 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [1,0,1,0,0,0|0,0,2]=4 2575 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [1,0,1,0,0,0|0,0,2]=4 2576 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [1,0,1,0,0,0|0,0,2]=4 2577 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [1,0,1,0,0,0|0,0,2]=4 2578 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [1,0,1,0,0,0|0,0,2]=4 2579 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [1,0,1,0,0,0|0,0,2]=4 2580 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [1,0,1,0,0,0|0,0,2]=4 2581 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [1,0,1,0,0,0|0,0,2]=4 2582 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [1,0,1,0,0,0|0,0,2]=4 2583 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [1,0,1,0,0,0|2,0,0]=4 2584 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [1,0,1,0,0,0|2,0,0]=4 2585 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [1,0,1,0,0,0|2,0,0]=4 2586 B7R0.5 CC(=O)N(C)CCN MCULE-3153405152 [1,0,1,0,0,0|2,0,0]=4 2587 B7R0.5 CC(=O)N(C)CCN MCULE-4043248689 [1,0,1,0,0,0|2,0,0]=4 2588 B7R0.5 CC(CCCl)C(=O)Cl MCULE-4844969943 [1,0,1,0,0,0|2,0,0]=4 2589 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,0,1,0,0,0|0,0,0]=2 2590 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,0,1,0,0,0|0,0,0]=2 2591 B7R0.5 CC(CCN)S(=O)C MCULE-4983155747 [1,0,1,0,0,0|2,0,0]=4 2592 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [1,0,1,0,0,0|2,0,0]=4 2593 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,0,1,0,0,0|1,0,0]=3 2594 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [1,0,1,0,0,0|1,0,1]=4 2595 B7R0.5 CC(NC=O)C(=O)O MCULE-7277951464 [1,0,1,0,0,0|1,0,1]=4 2596 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [1,0,1,0,0,0|0,0,2]=4 2597 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [1,0,1,0,0,0|0,0,2]=4 2598 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [1,0,1,0,0,0|0,0,2]=4 2599 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [1,0,1,0,0,0|1,0,1]=4 2600 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [1,0,1,0,0,0|2,0,0]=4 2601 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,0,1,0,0,0|1,0,0]=3 2602 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [1,0,1,0,0,0|1,0,0]=3 2603 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [1,0,1,0,0,0|1,0,0]=3 2604 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [1,0,1,0,0,0|1,0,0]=3 2605 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,0,1,0,0,0|0,0,0]=2 2606 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [1,0,1,0,0,0|1,0,1]=4 2607 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,0,1,0,0,0|1,0,0]=3 2608 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,0,1,0,0,0|1,0,0]=3 2609 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [1,0,1,0,0,0|1,0,0]=3 2610 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [1,0,1,0,0,0|1,0,0]=3 2611 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,0,1,0,0,0|0,0,0]=2 2612 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,0,1,0,0,0|0,0,0]=2 2613 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,0,1,0,0,0|0,0,0]=2 2614 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [1,0,1,0,0,0|2,0,0]=4 2615 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,0,1,0,0,0|1,0,0]=3 2616 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,0,1,0,0,0|1,0,0]=3 2617 B7R0.5 CCCN(C)C(=O)Cl MCULE-2930764127 [1,0,1,0,0,0|2,0,0]=4 2618 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,0,1,0,0,0|0,0,0]=2 2619 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,0,1,0,0,0|0,0,0]=2 2620 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,0,1,0,0,0|1,0,0]=3 2621 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,0,1,0,0,0|1,0,0]=3 2622 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [1,0,1,0,0,0|1,0,0]=3 2623 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [1,0,1,0,0,0|1,0,0]=3 2624 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [1,0,1,0,0,0|1,0,0]=3 2625 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [1,0,1,0,0,0|1,0,0]=3 2626 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,0,1,0,0,0|0,0,0]=2 2627 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,0,1,0,0,0|0,0,0]=2 2628 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,0,1,0,0,0|0,0,0]=2 2629 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,0,1,0,0,0|1,0,0]=3 2630 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,0,1,0,0,0|1,0,0]=3 2631 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [1,0,1,0,0,0|1,0,1]=4 2632 B7R0.5 CCNC(C)C(=O)N MCULE-2861818493 [1,0,1,0,0,0|1,0,0]=3 2633 B7R0.5 CCNC(C)C(=O)N MCULE-6110291237 [1,0,1,0,0,0|1,0,0]=3 2634 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [1,0,1,0,0,0|0,0,0]=2 2635 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [1,0,1,0,0,0|0,0,0]=2 2636 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [1,0,1,0,0,0|0,0,0]=2 2637 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [1,0,1,0,0,0|1,0,0]=3 2638 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [1,0,1,0,0,0|1,0,0]=3 2639 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,0,1,0,0,0|0,0,0]=2 2640 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,0,1,0,0,0|0,0,0]=2 2641 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [1,0,1,0,0,0|1,0,0]=3 2642 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [1,0,1,0,0,0|1,0,0]=3 2643 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [1,0,1,0,0,0|1,0,0]=3 2644 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [1,0,1,0,0,0|1,0,0]=3 2645 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [1,0,1,0,0,0|1,0,0]=3 2646 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [1,0,1,0,0,0|1,0,0]=3 2647 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [1,0,1,0,0,0|2,0,0]=4 2648 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [1,0,1,0,0,0|2,0,0]=4 2649 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,0,1,0,0,0|1,0,0]=3 2650 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [1,0,1,0,0,0|2,0,0]=4 2651 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [1,0,1,0,0,0|2,0,0]=4 2652 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [1,0,1,0,0,0|2,0,0]=4 2653 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [1,0,1,0,0,0|1,0,0]=3 2654 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [1,0,1,0,0,0|1,0,0]=3 2655 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [1,0,1,0,0,0|1,0,0]=3 2656 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [1,0,1,0,0,0|1,0,0]=3 2657 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,0,1,0,0,0|2,0,0]=4 2658 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [1,0,1,0,0,0|1,0,0]=3 2659 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [1,0,1,0,0,0|1,0,0]=3 2660 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [1,0,1,0,0,0|1,0,0]=3 2661 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [1,0,1,0,0,0|1,0,0]=3 2662 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [1,0,1,0,0,0|1,0,0]=3 2663 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [1,0,1,0,0,0|1,0,0]=3 2664 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [1,0,1,0,0,0|1,0,0]=3 2665 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [1,0,1,0,0,0|1,0,0]=3 2666 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,0,1,0,0,0|1,0,0]=3 2667 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [1,0,1,0,0,0|1,0,0]=3 2668 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [1,0,1,0,0,0|1,0,0]=3 2669 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [1,0,1,0,0,0|1,0,0]=3 2670 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,0,1,0,0,0|1,0,0]=3 2671 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-3824082361 [1,0,1,0,0,0|1,0,1]=4 2672 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-5248110352 [1,0,1,0,0,0|1,0,1]=4 2673 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [1,0,1,0,0,0|1,0,0]=3 2674 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [1,0,1,0,0,0|1,0,0]=3 2675 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [1,0,1,0,0,0|1,0,0]=3 2676 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [1,0,1,0,0,0|1,0,0]=3 2677 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [1,0,1,0,0,0|1,0,0]=3 2678 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [1,0,1,0,0,0|1,0,0]=3 2679 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [1,0,1,0,0,0|1,0,1]=4 2680 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [1,0,1,0,0,0|1,0,1]=4 2681 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [1,0,1,0,0,0|1,0,1]=4 2682 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [1,0,1,0,0,0|1,0,0]=3 2683 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [1,0,1,0,0,0|1,0,0]=3 2684 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [1,0,1,0,0,0|1,0,0]=3 2685 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [1,0,1,0,0,0|1,0,0]=3 2686 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [1,0,1,0,0,0|1,0,0]=3 2687 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [1,0,1,0,0,0|1,0,0]=3 2688 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [1,0,1,0,0,0|1,0,0]=3 2689 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [1,0,1,0,0,0|1,0,0]=3 2690 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [1,0,1,0,0,0|2,0,0]=4 2691 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [1,0,1,0,0,0|1,0,0]=3 2692 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [1,0,1,0,0,0|1,0,0]=3 2693 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [1,0,1,0,0,0|1,0,0]=3 2694 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [1,0,1,0,0,0|1,0,0]=3 2695 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [1,0,1,0,0,0|1,0,0]=3 2696 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [1,0,1,0,0,0|1,0,0]=3 2697 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [1,0,1,0,0,0|1,0,0]=3 2698 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [1,0,1,0,0,0|1,0,0]=3 2699 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [1,0,1,0,0,0|1,0,0]=3 2700 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,0,1,0,0,0|1,0,0]=3 2701 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,0,1,0,0,0|1,0,0]=3 2702 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [1,0,1,0,0,0|1,0,0]=3 2703 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [1,0,1,0,0,0|1,0,0]=3 2704 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [1,0,1,0,0,0|1,0,0]=3 2705 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [1,0,1,0,0,0|1,0,0]=3 2706 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,0,1,0,0,0|1,0,0]=3 2707 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [1,0,1,0,0,0|1,0,0]=3 2708 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [1,0,1,0,0,0|1,0,0]=3 2709 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [1,0,1,0,0,0|1,0,0]=3 2710 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [1,0,1,0,0,0|1,0,0]=3 2711 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [1,0,1,0,0,0|1,0,0]=3 2712 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [1,0,1,0,0,0|1,0,0]=3 2713 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [1,0,1,0,0,0|1,0,0]=3 2714 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [1,0,1,0,0,0|1,0,0]=3 2715 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [1,0,1,0,0,0|1,0,0]=3 2716 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,0,1,0,0,0|1,0,0]=3 2717 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,0,1,0,0,0|1,0,0]=3 2718 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [1,0,1,0,0,0|2,0,0]=4 2719 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [1,0,1,0,0,0|1,0,0]=3 2720 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [1,0,1,0,0,0|1,0,0]=3 2721 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [1,0,1,0,0,0|1,0,0]=3 2722 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [1,0,1,0,0,0|1,0,0]=3 2723 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [1,0,1,0,0,0|1,0,0]=3 2724 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [1,0,1,0,0,0|1,0,0]=3 2725 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [1,0,1,0,0,0|1,0,0]=3 2726 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [1,0,1,0,0,0|1,0,0]=3 2727 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [1,0,1,0,0,0|2,0,0]=4 2728 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [1,0,1,0,0,0|1,0,0]=3 2729 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [1,0,1,0,0,0|1,0,0]=3 2730 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [1,0,1,0,0,0|1,0,0]=3 2731 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [1,0,1,0,0,0|1,0,0]=3 2732 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [1,0,1,0,0,0|1,0,0]=3 2733 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [1,0,1,0,0,0|1,0,0]=3 2734 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [1,0,1,0,0,0|2,0,0]=4 2735 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,0,1,0,0,0|2,0,0]=4 2736 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [1,0,1,0,0,0|0,0,2]=4 2737 B7R0.12 CCCC(CN)OC MCULE-6456891707 [1,0,1,0,0,0|2,0,0]=4 2738 B7R0.12 CCCC(CO)CO MCULE-2372919180 [1,0,1,0,0,0|1,0,1]=4 2739 B7R0.15 C=C(C)C(CC)CC MCULE-2424136176 [1,0,1,0,0,0|2,0,0]=4 2740 B7R0.15 CC=C(CC)C(=O)O MCULE-9303879981 [1,0,1,0,0,0|0,0,2]=4 2741 B7R0.15 CCC(C#N)C(=O)O MCULE-4808497444 [1,0,1,0,0,0|0,0,2]=4 2742 B7R0.15 CCC(CC)C(=O)C MCULE-5291760485 [1,0,1,0,0,0|1,0,0]=3 2743 B7R0.15 CCC(CC)C(=O)Cl MCULE-1027070009 [1,0,1,0,0,0|1,0,0]=3 2744 B7R0.15 CCC(CC)C(=O)N MCULE-7337294425 [1,0,1,0,0,0|1,0,0]=3 2745 B7R0.15 CCC(CC)C(=O)O MCULE-5236890306 [1,0,1,0,0,0|0,0,0]=2 2746 B7R0.15 CCC(CC)C(=S)N MCULE-8027076934 [1,0,1,0,0,0|1,1,0]=4 2747 B7R0.15 CCC(CC)C(C)O MCULE-9742014522 [1,0,1,0,0,0|1,0,1]=4 2748 B7R0.15 CCC(CN)C(=O)O MCULE-3795207054 [1,0,1,0,0,0|0,0,0]=2 2749 B7R0.15 CCC(CN)C(=O)O MCULE-3929048283 [1,0,1,0,0,0|0,0,0]=2 2750 B7R0.15 CCC(CO)C(=O)O MCULE-9435802738 [1,0,1,0,0,0|1,0,0]=3 2751 B7R0.15 CCC(CO)C(=O)[O-] MCULE-4277685135 [1,0,1,0,0,0|1,0,1]=4 2752 B7R0.15 CCC(NC)C(=O)N MCULE-1925914686 [1,0,1,0,0,0|1,0,0]=3 2753 B7R0.15 CCC(NC)C(=O)N MCULE-3283265693 [1,0,1,0,0,0|1,0,0]=3 2754 B7R0.15 CCC(NC)C(=O)O MCULE-4101988968 [1,0,1,0,0,0|0,0,0]=2 2755 B7R0.15 CCC(NC)C(=O)O MCULE-4491873969 [1,0,1,0,0,0|0,0,0]=2 2756 B7R0.15 CCC(NN)C(=O)O MCULE-8823684595 [1,0,1,0,0,0|1,0,0]=3 2757 B7R0.15 CCC(NO)C(=O)O MCULE-1962461048 [1,0,1,0,0,0|1,0,0]=3 2758 B7R0.15 CCC(OC)C(=O)N MCULE-4022181907 [1,0,1,0,0,0|2,0,0]=4 2759 B7R0.15 CCC(OC)C(=O)O MCULE-2475290794 [1,0,1,0,0,0|1,0,0]=3 2760 B7R0.15 CCC(SC)C(=O)O MCULE-3373016779 [1,0,1,0,0,0|1,0,0]=3 2761 B7R0.15 CCN(CC)C(=O)C MCULE-6584128098 [1,0,1,0,0,0|2,0,0]=4 2762 B7R0.15 CCN(CC)C(=O)Cl MCULE-2162985195 [1,0,1,0,0,0|2,0,0]=4 2763 B7R0.15 CCN(CC)C(=O)N MCULE-7011051295 [1,0,1,0,0,0|2,0,0]=4 2764 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-3190659348 [1,0,1,0,0,0|0,0,0]=2 2765 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-5613487575 [1,0,1,0,0,0|0,0,0]=2 2766 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-6726398435 [1,0,1,0,0,0|0,0,0]=2 2767 B7R0.15 CC[C@H](CN)C(=O)O MCULE-2222410753 [1,0,1,0,0,0|0,0,0]=2 2768 B7R0.15 CC[C@H](CN)C(=O)O MCULE-3153536523 [1,0,1,0,0,0|0,0,0]=2 2769 B7R0.15 CC[C@H](CO)C(=O)O MCULE-3017159819 [1,0,1,0,0,0|1,0,0]=3 2770 B7R0.15 CC[C@H](NC)C(=O)N MCULE-6927041915 [1,0,1,0,0,0|1,0,0]=3 2771 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8566282898 [1,0,1,0,0,0|1,0,0]=3 2772 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8659413445 [1,0,1,0,0,0|1,0,0]=3 2773 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8863599251 [1,0,1,0,0,0|1,0,0]=3 2774 B7R0.15 CNC(CN)C(=O)N MCULE-4431940195 [1,0,1,0,0,0|2,0,0]=4 2775 B7R0.15 CNC(CO)C(=O)O MCULE-1439435474 [1,0,1,0,0,0|1,0,0]=3 2776 B7R0.15 CNC(CO)C(=O)O MCULE-7611211207 [1,0,1,0,0,0|1,0,0]=3 2777 B7R0.15 CNC(CS)C(=O)O MCULE-4817727684 [1,0,1,0,0,0|1,0,0]=3 2778 B7R0.15 CNC(CS)C(=O)O MCULE-5741984055 [1,0,1,0,0,0|1,0,0]=3 2779 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3196852022 [1,0,1,0,0,0|1,0,0]=3 2780 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3690177999 [1,0,1,0,0,0|1,0,0]=3 2781 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-3320307572 [1,0,1,0,0,0|1,0,0]=3 2782 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-5844994620 [1,0,1,0,0,0|1,0,0]=3 2783 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6293854138 [1,0,1,0,0,0|1,0,0]=3 2784 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6463850730 [1,0,1,0,0,0|1,0,0]=3 2785 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-3043115433 [1,0,1,0,0,0|1,0,0]=3 2786 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-8814760080 [1,0,1,0,0,0|1,0,0]=3 2787 B7R0.15 CN[C@H](CO)C(=O)O MCULE-1791141182 [1,0,1,0,0,0|1,0,0]=3 2788 B7R0.15 CN[C@H](CO)C(=O)O MCULE-9346314213 [1,0,1,0,0,0|1,0,0]=3 2789 B7R0.15 COC(CBr)C(=O)O MCULE-5528365617 [1,0,1,0,0,0|2,0,0]=4 2790 B7R0.15 COC(CN)C(=O)N MCULE-3215392526 [1,0,1,0,0,0|2,0,0]=4 2791 B7R0.15 COC(CN)C(=O)O MCULE-1561937449 [1,0,1,0,0,0|1,0,0]=3 2792 B7R0.15 COC(CN)C(=O)O MCULE-7501291426 [1,0,1,0,0,0|1,0,0]=3 2793 B7R0.15 COC(OC)C(=O)O MCULE-3341727181 [1,0,1,0,0,0|2,0,0]=4 2794 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-5536624827 [1,0,1,0,0,0|1,0,0]=3 2795 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-6198841067 [1,0,1,0,0,0|1,0,0]=3 2796 B7R0.15 N#CC(CN)C(=O)O MCULE-3513807694 [1,0,1,0,0,0|1,0,1]=4 2797 B7R0.15 NCC(CO)C(=O)O MCULE-5510878508 [1,0,1,0,0,0|1,0,0]=3 2798 B7R0.15 NCC(CO)C(=O)O MCULE-9991285445 [1,0,1,0,0,0|1,0,0]=3 2799 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-4607648703 [1,0,1,0,0,0|1,0,0]=3 2800 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-8943978569 [1,0,1,0,0,0|1,0,0]=3 2801 B7R0.15 NC[C@H](CO)C(=O)O MCULE-8459713640 [1,0,1,0,0,0|1,0,0]=3 2802 B7R0.15 O=C(O)C(CBr)CBr MCULE-5180730979 [1,0,1,0,0,0|2,0,0]=4 2803 B7R0.15 O=C(O)C(CS)CS MCULE-3175815620 [1,0,1,0,0,0|2,0,0]=4 2804 B7R0.15 O=C(O)[C@H](CO)NP MCULE-8418001133 [1,0,1,0,0,0|2,0,0]=4 2805 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [2,0,0,0,0,0|2,0,0]=4 2806 B7R1.3 BrC1CCCNC1 MCULE-5734359694 [2,0,0,0,0,0|1,0,0]=3 2807 B7R1.3 BrC1CCCNC1 MCULE-8772964999 [2,0,0,0,0,0|1,0,0]=3 2808 B7R1.3 BrC1CCCNC1 MCULE-9975168983 [2,0,0,0,0,0|1,0,0]=3 2809 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [2,0,0,0,0,0|2,0,0]=4 2810 B7R1.3 C1(CCCNC1)F MCULE-2873742972 [2,0,0,0,0,0|1,0,0]=3 2811 B7R1.3 C1(CCCNC1)F MCULE-8247715411 [2,0,0,0,0,0|1,0,0]=3 2812 B7R1.3 C1(CCCNC1)N MCULE-2184623611 [2,0,0,0,0,0|1,0,0]=3 2813 B7R1.3 C1(CCCNC1)N MCULE-6177601832 [2,0,0,0,0,0|1,0,0]=3 2814 B7R1.3 C1(CCCNC1)O MCULE-5944071030 [2,0,0,0,0,0|0,0,0]=2 2815 B7R1.3 C1(CCCNC1)O MCULE-9769032939 [2,0,0,0,0,0|0,0,0]=2 2816 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [2,0,0,0,0,0|2,0,0]=4 2817 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [2,0,0,0,0,0|2,0,0]=4 2818 B7R1.3 C1(CNCCN1)C MCULE-7759957935 [2,0,0,0,0,0|1,0,1]=4 2819 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [2,0,0,0,0,0|1,0,1]=4 2820 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [2,0,0,0,0,0|1,0,1]=4 2821 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [2,0,0,0,0,0|1,0,1]=4 2822 B7R1.3 C=C1CCCNC1 MCULE-2588575300 [2,0,0,0,0,0|0,0,1]=3 2823 B7R1.3 C=C1CCCNC1 MCULE-9758065019 [2,0,0,0,0,0|0,0,1]=3 2824 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [2,0,0,0,0,0|1,0,1]=4 2825 B7R1.3 CC1CCCCC1 MCULE-3843525768 [2,0,0,0,0,0|1,0,1]=4 2826 B7R1.3 CC1CCCNC1 MCULE-3344207132 [2,0,0,0,0,0|0,0,1]=3 2827 B7R1.3 CC1CCCNC1 MCULE-5707832183 [2,0,0,0,0,0|0,0,1]=3 2828 B7R1.3 CC1CCCNC1 MCULE-7033850891 [2,0,0,0,0,0|0,0,1]=3 2829 B7R1.3 CC1CCCNC1 MCULE-7153943487 [2,0,0,0,0,0|0,0,1]=3 2830 B7R1.3 CC1CNCCN1 MCULE-2536395443 [2,0,0,0,0,0|1,0,1]=4 2831 B7R1.3 CC1CNCCN1 MCULE-6313957247 [2,0,0,0,0,0|1,0,1]=4 2832 B7R1.3 CC1CNCCO1 MCULE-3071497485 [2,0,0,0,0,0|1,0,1]=4 2833 B7R1.3 CC1CNCCO1 MCULE-7956728736 [2,0,0,0,0,0|1,0,1]=4 2834 B7R1.3 CC1CNCCS1 MCULE-7391261862 [2,0,0,0,0,0|1,0,1]=4 2835 B7R1.3 C[C@@H]1CCCNC1 MCULE-1079173995 [2,0,0,0,0,0|0,0,1]=3 2836 B7R1.3 C[C@@H]1CCCNC1 MCULE-1230145662 [2,0,0,0,0,0|0,0,1]=3 2837 B7R1.3 C[C@@H]1CCCNC1 MCULE-3423787676 [2,0,0,0,0,0|0,0,1]=3 2838 B7R1.3 C[C@@H]1CCCNC1 MCULE-9303264483 [2,0,0,0,0,0|0,0,1]=3 2839 B7R1.3 C[C@@H]1CNCCN1 MCULE-2959336973 [2,0,0,0,0,0|1,0,1]=4 2840 B7R1.3 C[C@@H]1CNCCN1 MCULE-3870060141 [2,0,0,0,0,0|1,0,1]=4 2841 B7R1.3 C[C@@H]1CNCCN1 MCULE-4214817913 [2,0,0,0,0,0|1,0,1]=4 2842 B7R1.3 C[C@@H]1CNCCN1 MCULE-4368092239 [2,0,0,0,0,0|1,0,1]=4 2843 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [2,0,0,0,0,0|1,0,1]=4 2844 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [2,0,0,0,0,0|1,0,1]=4 2845 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [2,0,0,0,0,0|1,0,1]=4 2846 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [2,0,0,0,0,0|1,0,1]=4 2847 B7R1.3 C[C@H]1CCCNC1 MCULE-3372852932 [2,0,0,0,0,0|0,0,1]=3 2848 B7R1.3 C[C@H]1CCCNC1 MCULE-5146147676 [2,0,0,0,0,0|0,0,1]=3 2849 B7R1.3 C[C@H]1CCCNC1 MCULE-7894943546 [2,0,0,0,0,0|0,0,1]=3 2850 B7R1.3 C[C@H]1CCCNC1 MCULE-8016414984 [2,0,0,0,0,0|0,0,1]=3 2851 B7R1.3 C[C@H]1CNCCN1 MCULE-1403559972 [2,0,0,0,0,0|1,0,1]=4 2852 B7R1.3 C[C@H]1CNCCN1 MCULE-5769724060 [2,0,0,0,0,0|1,0,1]=4 2853 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [2,0,0,0,0,0|1,0,1]=4 2854 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [2,0,0,0,0,0|1,0,1]=4 2855 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [2,0,0,0,0,0|1,0,1]=4 2856 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [2,0,0,0,0,0|1,0,1]=4 2857 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [2,0,0,0,0,0|2,0,0]=4 2858 B7R1.3 ClC1CCCNC1 MCULE-3870722463 [2,0,0,0,0,0|1,0,0]=3 2859 B7R1.3 ClC1CCCNC1 MCULE-8461718443 [2,0,0,0,0,0|1,0,0]=3 2860 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [2,0,0,0,0,0|2,0,0]=4 2861 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-1513190720 [2,0,0,0,0,0|1,0,0]=3 2862 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-4702442384 [2,0,0,0,0,0|1,0,0]=3 2863 B7R1.3 Cl[C@H]1CCCNC1 MCULE-1906196638 [2,0,0,0,0,0|1,0,0]=3 2864 B7R1.3 Cl[C@H]1CCCNC1 MCULE-5435721723 [2,0,0,0,0,0|1,0,0]=3 2865 B7R1.3 FC1CCCCC1 MCULE-4555555520 [2,0,0,0,0,0|2,0,0]=4 2866 B7R1.3 FC1CCCNC1 MCULE-1207637035 [2,0,0,0,0,0|1,0,0]=3 2867 B7R1.3 FC1CCCNC1 MCULE-8874983109 [2,0,0,0,0,0|1,0,0]=3 2868 B7R1.3 FC1CCCOC1 MCULE-9003204358 [2,0,0,0,0,0|2,0,0]=4 2869 B7R1.3 F[C@@H]1CCCNC1 MCULE-1015853975 [2,0,0,0,0,0|1,0,0]=3 2870 B7R1.3 F[C@@H]1CCCNC1 MCULE-2442101978 [2,0,0,0,0,0|1,0,0]=3 2871 B7R1.3 F[C@@H]1CCCNC1 MCULE-3088687742 [2,0,0,0,0,0|1,0,0]=3 2872 B7R1.3 F[C@@H]1CCCNC1 MCULE-3298158493 [2,0,0,0,0,0|1,0,0]=3 2873 B7R1.3 F[C@H]1CCCNC1 MCULE-5863769143 [2,0,0,0,0,0|1,0,0]=3 2874 B7R1.3 F[C@H]1CCCNC1 MCULE-9142728260 [2,0,0,0,0,0|1,0,0]=3 2875 B7R1.3 F[C@H]1CCCNC1 MCULE-9496728832 [2,0,0,0,0,0|1,0,0]=3 2876 B7R1.3 F[C@H]1CCCNC1 MCULE-9795686850 [2,0,0,0,0,0|1,0,0]=3 2877 B7R1.3 IC1CCCCC1 MCULE-4499971048 [2,0,0,0,0,0|2,0,0]=4 2878 B7R1.3 NC1CCCCC1 MCULE-1274688385 [2,0,0,0,0,0|2,0,0]=4 2879 B7R1.3 NC1CCCCC1 MCULE-6218418825 [2,0,0,0,0,0|2,0,0]=4 2880 B7R1.3 NC1CCCCC1 MCULE-7654331405 [2,0,0,0,0,0|2,0,0]=4 2881 B7R1.3 NC1CCCCC1 MCULE-9211684304 [2,0,0,0,0,0|2,0,0]=4 2882 B7R1.3 NC1CCCNC1 MCULE-2846077424 [2,0,0,0,0,0|1,0,0]=3 2883 B7R1.3 NC1CCCNC1 MCULE-6762552983 [2,0,0,0,0,0|1,0,0]=3 2884 B7R1.3 NC1CCCNC1 MCULE-8978449052 [2,0,0,0,0,0|1,0,0]=3 2885 B7R1.3 NC1CCCOC1 MCULE-3002610862 [2,0,0,0,0,0|2,0,0]=4 2886 B7R1.3 NC1CCCOC1 MCULE-8678558313 [2,0,0,0,0,0|2,0,0]=4 2887 B7R1.3 NC1CCCSC1 MCULE-5361360271 [2,0,0,0,0,0|2,0,0]=4 2888 B7R1.3 NC1CCCSC1 MCULE-5652416535 [2,0,0,0,0,0|2,0,0]=4 2889 B7R1.3 N[C@@H]1CCCNC1 MCULE-1539406556 [2,0,0,0,0,0|1,0,0]=3 2890 B7R1.3 N[C@@H]1CCCNC1 MCULE-3403472114 [2,0,0,0,0,0|1,0,0]=3 2891 B7R1.3 N[C@@H]1CCCNC1 MCULE-6313396868 [2,0,0,0,0,0|1,0,0]=3 2892 B7R1.3 N[C@@H]1CCCNC1 MCULE-8281902784 [2,0,0,0,0,0|1,0,0]=3 2893 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [2,0,0,0,0,0|2,0,0]=4 2894 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [2,0,0,0,0,0|2,0,0]=4 2895 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [2,0,0,0,0,0|2,0,0]=4 2896 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [2,0,0,0,0,0|2,0,0]=4 2897 B7R1.3 N[C@H]1CCCNC1 MCULE-1133561466 [2,0,0,0,0,0|1,0,0]=3 2898 B7R1.3 N[C@H]1CCCNC1 MCULE-3601314617 [2,0,0,0,0,0|1,0,0]=3 2899 B7R1.3 N[C@H]1CCCNC1 MCULE-4741120465 [2,0,0,0,0,0|1,0,0]=3 2900 B7R1.3 N[C@H]1CCCNC1 MCULE-5291619589 [2,0,0,0,0,0|1,0,0]=3 2901 B7R1.3 N[C@H]1CCCNC1 MCULE-8831721515 [2,0,0,0,0,0|1,0,0]=3 2902 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [2,0,0,0,0,0|2,0,0]=4 2903 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [2,0,0,0,0,0|2,0,0]=4 2904 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [2,0,0,0,0,0|2,0,0]=4 2905 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [2,0,0,0,0,0|2,0,0]=4 2906 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [2,0,0,0,0,0|1,0,1]=4 2907 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [2,0,0,0,0,0|0,0,1]=3 2908 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [2,0,0,0,0,0|0,0,1]=3 2909 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [2,0,0,0,0,0|1,0,1]=4 2910 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [2,0,0,0,0,0|1,0,1]=4 2911 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [2,0,0,0,0,0|1,0,1]=4 2912 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [2,0,0,0,0,0|1,0,1]=4 2913 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [2,0,0,0,0,0|1,0,1]=4 2914 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [2,0,0,0,0,0|2,0,0]=4 2915 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [2,0,0,0,0,0|2,0,0]=4 2916 B7R1.3 OC1C=CCCC1 MCULE-3255466542 [2,0,0,0,0,0|1,0,1]=4 2917 B7R1.3 OC1C=CCNC1 MCULE-1616136732 [2,0,0,0,0,0|0,0,2]=4 2918 B7R1.3 OC1C=CCNC1 MCULE-6073391464 [2,0,0,0,0,0|0,0,2]=4 2919 B7R1.3 OC1CC=CCC1 MCULE-9472259407 [2,0,0,0,0,0|1,0,1]=4 2920 B7R1.3 OC1CCCCC1 MCULE-8217921343 [2,0,0,0,0,0|1,0,0]=3 2921 B7R1.3 OC1CCCCN1 MCULE-7168605870 [2,0,0,0,0,0|2,0,0]=4 2922 B7R1.3 OC1CCCCN1 MCULE-9833825308 [2,0,0,0,0,0|2,0,0]=4 2923 B7R1.3 OC1CCCCO1 MCULE-1415784498 [2,0,0,0,0,0|2,0,0]=4 2924 B7R1.3 OC1CCCNC1 MCULE-4557845355 [2,0,0,0,0,0|0,0,0]=2 2925 B7R1.3 OC1CCCNC1 MCULE-6040312691 [2,0,0,0,0,0|0,0,0]=2 2926 B7R1.3 OC1CCCOC1 MCULE-3820663957 [2,0,0,0,0,0|1,0,0]=3 2927 B7R1.3 OC1CCCOC1 MCULE-4349250540 [2,0,0,0,0,0|1,0,0]=3 2928 B7R1.3 OC1CCCSC1 MCULE-1448781710 [2,0,0,0,0,0|1,0,0]=3 2929 B7R1.3 OC1CCNCC1 MCULE-3572807775 [2,0,0,0,0,0|2,0,0]=4 2930 B7R1.3 OC1CCNCC1 MCULE-4216905638 [2,0,0,0,0,0|2,0,0]=4 2931 B7R1.3 OC1CCNCC1 MCULE-8298401309 [2,0,0,0,0,0|2,0,0]=4 2932 B7R1.3 OC1CCOCC1 MCULE-3789534226 [2,0,0,0,0,0|2,0,0]=4 2933 B7R1.3 OC1CCSCC1 MCULE-6056663037 [2,0,0,0,0,0|2,0,0]=4 2934 B7R1.3 OC1CNCCO1 MCULE-7048275202 [2,0,0,0,0,0|1,0,0]=3 2935 B7R1.3 OC1CNCCO1 MCULE-9716087824 [2,0,0,0,0,0|1,0,0]=3 2936 B7R1.3 OC1COCOC1 MCULE-1056094446 [2,0,0,0,0,0|2,0,0]=4 2937 B7R1.3 ON1CCCCC1 MCULE-5529301217 [2,0,0,0,0,0|2,0,0]=4 2938 B7R1.3 O[C@@H]1CCCNC1 MCULE-3395625072 [2,0,0,0,0,0|0,0,0]=2 2939 B7R1.3 O[C@@H]1CCCNC1 MCULE-5041834047 [2,0,0,0,0,0|0,0,0]=2 2940 B7R1.3 O[C@@H]1CCCNC1 MCULE-5939951996 [2,0,0,0,0,0|0,0,0]=2 2941 B7R1.3 O[C@@H]1CCCNC1 MCULE-8822637089 [2,0,0,0,0,0|0,0,0]=2 2942 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [2,0,0,0,0,0|1,0,0]=3 2943 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [2,0,0,0,0,0|1,0,0]=3 2944 B7R1.3 O[C@H]1C=CCCC1 MCULE-5543899109 [2,0,0,0,0,0|1,0,1]=4 2945 B7R1.3 O[C@H]1CCCNC1 MCULE-3813591488 [2,0,0,0,0,0|0,0,0]=2 2946 B7R1.3 O[C@H]1CCCNC1 MCULE-5223055424 [2,0,0,0,0,0|0,0,0]=2 2947 B7R1.3 O[C@H]1CCCNC1 MCULE-7646198322 [2,0,0,0,0,0|0,0,0]=2 2948 B7R1.3 O[C@H]1CCCNC1 MCULE-7875547684 [2,0,0,0,0,0|0,0,0]=2 2949 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [2,0,0,0,0,0|1,0,0]=3 2950 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [2,0,0,0,0,0|1,0,0]=3 2951 B7R1.3 SC1CCCCC1 MCULE-2644288416 [2,0,0,0,0,0|1,1,0]=4 2952 B7R1.3 SC1CCCNC1 MCULE-4464031027 [2,0,0,0,0,0|0,1,0]=3 2953 B7R1.3 SC1CCCNC1 MCULE-5566651293 [2,0,0,0,0,0|0,1,0]=3 2954 B7R1.3 SC1CCCOC1 MCULE-9540212924 [2,0,0,0,0,0|1,1,0]=4 2955 B7R1.3 S[C@H]1CCCNC1 MCULE-5377455102 [2,0,0,0,0,0|0,1,0]=3 2956 B7R1.3 S[C@H]1CCCNC1 MCULE-9668422285 [2,0,0,0,0,0|0,1,0]=3 2957 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [2,0,0,0,0,0|2,0,0]=4 2958 B9R0.1 CCC(=CCCC(=O)O)C MCULE-6674917264 [0,1,1,0,0,0|1,0,1]=4 2959 B9R0.1 CCC(=O)CCCC(=O)O MCULE-9954859815 [0,1,1,0,0,0|1,0,1]=4 2960 B9R0.1 CCC(=O)NCCC(=O)O MCULE-8290753533 [0,1,1,0,0,0|0,0,1]=3 2961 B9R0.1 CCC(C)CCCC(=O)O MCULE-5124776736 [0,1,1,0,0,0|1,0,0]=3 2962 B9R0.1 CCC(C)NCCC(=O)N MCULE-1926892639 [0,1,1,0,0,0|1,0,0]=3 2963 B9R0.1 CCC(C)NCCC(=O)N MCULE-9191758717 [0,1,1,0,0,0|1,0,0]=3 2964 B9R0.1 CCC(C)OCCC(=O)C MCULE-5228891169 [0,1,1,0,0,0|2,0,0]=4 2965 B9R0.1 CNC(=O)CCCC(=O)O MCULE-1504372631 [0,1,1,0,0,0|0,0,1]=3 2966 B9R0.1 CNC(=O)COCC(=O)O MCULE-6654181237 [0,1,1,0,0,0|1,0,1]=4 2967 B9R0.1 CNC(=O)NCCC(=O)O MCULE-2339960341 [0,1,1,0,0,0|1,0,1]=4 2968 B9R0.1 COC(=O)CCCC(=O)O MCULE-9458960872 [0,1,1,0,0,0|1,0,1]=4 2969 B9R0.1 COC(=O)NCCC(=O)O MCULE-2819384794 [0,1,1,0,0,0|1,0,1]=4 2970 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [0,1,1,0,0,0|2,0,0]=4 2971 B9R0.1 O=C(O)CCNC(=O)CBr MCULE-6072289927 [0,1,1,0,0,0|1,0,1]=4 2972 B9R0.1 O=C(O)CCNC(=O)CCl MCULE-4076619762 [0,1,1,0,0,0|1,0,1]=4 2973 B9R0.1 O=C(O)CCNC(=O)CO MCULE-2710668626 [0,1,1,0,0,0|1,0,1]=4 2974 B9R0.2 C#CCCCCCC(=O)O MCULE-4594227399 [0,1,1,0,0,0|1,0,1]=4 2975 B9R0.2 C=CCCCCCC(=O)O MCULE-6571932731 [0,1,1,0,0,0|1,0,1]=4 2976 B9R0.2 C=CCOCCCC(=O)O MCULE-5276221892 [0,1,1,0,0,0|1,0,1]=4 2977 B9R0.2 CC(=O)CCCCCCN MCULE-5842243037 [0,1,1,0,0,0|2,0,0]=4 2978 B9R0.2 CC(=O)CCCCCCN MCULE-6017408205 [0,1,1,0,0,0|2,0,0]=4 2979 B9R0.2 CCCC/C=C/CC(=O)O MCULE-3008379579 [0,1,1,0,0,0|1,0,1]=4 2980 B9R0.2 CCCC=CCCC(=O)O MCULE-8091554117 [0,1,1,0,0,0|1,0,0]=3 2981 B9R0.2 CCCCC#CCC(=O)O MCULE-2685341100 [0,1,1,0,0,0|1,0,1]=4 2982 B9R0.2 CCCCC/C=C/C(=O)O MCULE-5661205729 [0,1,1,0,0,0|1,0,1]=4 2983 B9R0.2 CCCCC=CCC(=O)O MCULE-1531958630 [0,1,1,0,0,0|1,0,1]=4 2984 B9R0.2 CCCCCC#CC(=O)O MCULE-1860076106 [0,1,1,0,0,0|1,0,1]=4 2985 B9R0.2 CCCCCC=CC(=O)O MCULE-6969617806 [0,1,1,0,0,0|1,0,1]=4 2986 B9R0.2 CCCCCCCC(=O)C MCULE-9635928766 [0,1,1,0,0,0|2,0,0]=4 2987 B9R0.2 CCCCCCCC(=O)Cl MCULE-9979489292 [0,1,1,0,0,0|2,0,0]=4 2988 B9R0.2 CCCCCCCC(=O)N MCULE-8774193381 [0,1,1,0,0,0|2,0,0]=4 2989 B9R0.2 CCCCCCCC(=O)O MCULE-5193957469 [0,1,1,0,0,0|1,0,0]=3 2990 B9R0.2 CCCCCCCC(=O)[O-] MCULE-3608650495 [0,1,1,0,0,0|1,0,1]=4 2991 B9R0.2 CCCCCCCC(=O)[O-] MCULE-8227046407 [0,1,1,0,0,0|1,0,1]=4 2992 B9R0.2 CCCCCCNC(=O)N MCULE-4236638652 [0,1,1,0,0,0|2,0,0]=4 2993 B9R0.2 CCCCCCOC(=O)C MCULE-7353613022 [0,1,1,0,0,0|2,0,0]=4 2994 B9R0.2 CCCCCCOC(=O)Cl MCULE-3135055168 [0,1,1,0,0,0|2,0,0]=4 2995 B9R0.2 CCCCCCOC(=O)N MCULE-3909923308 [0,1,1,0,0,0|2,0,0]=4 2996 B9R0.2 CCCCCNCC(=O)N MCULE-1817354788 [0,1,1,0,0,0|2,0,0]=4 2997 B9R0.2 CCCCCNCC(=O)N MCULE-5558188497 [0,1,1,0,0,0|2,0,0]=4 2998 B9R0.2 CCCCCOCC(=O)O MCULE-8190672624 [0,1,1,0,0,0|1,0,0]=3 2999 B9R0.2 CCCCOCCC(=O)O MCULE-3735085695 [0,1,1,0,0,0|1,0,0]=3 3000 B9R0.2 CCCCSCCC(=O)O MCULE-7414288717 [0,1,1,0,0,0|1,0,0]=3 3001 B9R0.2 CCCOCCCC(=O)O MCULE-8829980105 [0,1,1,0,0,0|1,0,0]=3 3002 B9R0.2 CCCOCCOC(=O)Cl MCULE-3909524059 [0,1,1,0,0,0|2,0,0]=4 3003 B9R0.2 CCCSCCCC(=O)O MCULE-9850452520 [0,1,1,0,0,0|1,0,0]=3 3004 B9R0.2 CCNCCCCC(=O)O MCULE-1386195341 [0,1,1,0,0,0|0,0,0]=2 3005 B9R0.2 CCNCCCCC(=O)O MCULE-1922836400 [0,1,1,0,0,0|0,0,0]=2 3006 B9R0.2 CCOCCCCC(=O)O MCULE-8522289104 [0,1,1,0,0,0|1,0,0]=3 3007 B9R0.2 CCOCCOCC(=O)O MCULE-2273372397 [0,1,1,0,0,0|2,0,0]=4 3008 B9R0.2 CNCCCCCC(=O)O MCULE-8016435275 [0,1,1,0,0,0|0,0,0]=2 3009 B9R0.2 CNCCOCCC(=O)O MCULE-6581967922 [0,1,1,0,0,0|0,0,0]=2 3010 B9R0.2 COCCCCCC(=O)O MCULE-1769987918 [0,1,1,0,0,0|1,0,0]=3 3011 B9R0.2 COCCCCOC(=O)C MCULE-4352807618 [0,1,1,0,0,0|2,0,0]=4 3012 B9R0.2 COCCCOCC(=O)O MCULE-7774967166 [0,1,1,0,0,0|1,0,0]=3 3013 B9R0.2 COCCNCCC(=O)N MCULE-2441989659 [0,1,1,0,0,0|1,0,0]=3 3014 B9R0.2 COCCNCCC(=O)O MCULE-3571993123 [0,1,1,0,0,0|0,0,0]=2 3015 B9R0.2 COCCOCCC(=O)O MCULE-5125891492 [0,1,1,0,0,0|1,0,0]=3 3016 B9R0.2 CSCCCCCC(=O)O MCULE-9069370044 [0,1,1,0,0,0|1,0,0]=3 3017 B9R0.2 C[NH2+]CCCCCC(=O)O MCULE-8971339830 [0,1,1,0,0,0|0,0,1]=3 3018 B9R0.2 N#CCCCCCC(=O)O MCULE-6510846674 [0,1,1,0,0,0|1,0,1]=4 3019 B9R0.2 N#CCCNCCC(=O)O MCULE-5749626028 [0,1,1,0,0,0|0,0,1]=3 3020 B9R0.2 N#N=NCCCCC(=O)O MCULE-6676414217 [0,1,1,0,0,0|1,0,1]=4 3021 B9R0.2 NC(=O)CCCCCCO MCULE-7432797193 [0,1,1,0,0,0|2,0,0]=4 3022 B9R0.2 NC(=O)CCNCCCO MCULE-1089880795 [0,1,1,0,0,0|1,0,0]=3 3023 B9R0.2 NC(=O)CCNCCCO MCULE-8808474432 [0,1,1,0,0,0|1,0,0]=3 3024 B9R0.2 NCCCCCCC(=O)N MCULE-9587339996 [0,1,1,0,0,0|2,0,0]=4 3025 B9R0.2 NCCCCCCC(=O)O MCULE-6089872609 [0,1,1,0,0,0|1,0,0]=3 3026 B9R0.2 NCCCCCCC(=O)O MCULE-7769232328 [0,1,1,0,0,0|1,0,0]=3 3027 B9R0.2 NCCSSCCC(=O)O MCULE-2378332819 [0,1,1,0,0,0|2,0,0]=4 3028 B9R0.2 NCCSSCCC(=O)O MCULE-4249865017 [0,1,1,0,0,0|2,0,0]=4 3029 B9R0.2 NOCCCCCC(=O)O MCULE-3221083368 [0,1,1,0,0,0|2,0,0]=4 3030 B9R0.2 NOCCCCCC(=O)O MCULE-6721085396 [0,1,1,0,0,0|2,0,0]=4 3031 B9R0.2 NOCCCCCC(=O)O MCULE-7170875932 [0,1,1,0,0,0|2,0,0]=4 3032 B9R0.2 O=C(O)CCCCCCBr MCULE-3980379488 [0,1,1,0,0,0|1,0,0]=3 3033 B9R0.2 O=C(O)CCCCCCF MCULE-7539264820 [0,1,1,0,0,0|1,0,0]=3 3034 B9R0.2 O=C(O)CCCCCCO MCULE-7270362706 [0,1,1,0,0,0|1,0,0]=3 3035 B9R0.2 O=C(O)CCCCCCS MCULE-5659986053 [0,1,1,0,0,0|1,0,0]=3 3036 B9R0.2 O=C(O)CCCNCCO MCULE-8202070706 [0,1,1,0,0,0|1,0,0]=3 3037 B9R0.2 O=C(O)CNCCCCO MCULE-6377863888 [0,1,1,0,0,0|2,0,0]=4 3038 B9R0.2 O=CCCCCCC(=O)O MCULE-1442157793 [0,1,1,0,0,0|1,0,1]=4 3039 B9R0.4 C=CCCC(N)CC(=O)O MCULE-1616151020 [0,1,1,0,0,0|1,0,1]=4 3040 B9R0.4 C=CCCC(N)CC(=O)O MCULE-6121434138 [0,1,1,0,0,0|1,0,1]=4 3041 B9R0.4 CC(CC(=O)O)NCCO MCULE-6990108869 [0,1,1,0,0,0|1,0,0]=3 3042 B9R0.4 CCCCC(C)CC(=O)O MCULE-1674327007 [0,1,1,0,0,0|1,0,0]=3 3043 B9R0.4 CCCCC(N)CC(=O)O MCULE-4002800812 [0,1,1,0,0,0|1,0,0]=3 3044 B9R0.4 CCCCC(N)CC(=O)O MCULE-8705314129 [0,1,1,0,0,0|1,0,0]=3 3045 B9R0.4 CCCCC(O)CC(=O)O MCULE-6348296633 [0,1,1,0,0,0|1,0,0]=3 3046 B9R0.4 CCCC[C@@H](N)CC(=O)O MCULE-8271790861 [0,1,1,0,0,0|1,0,0]=3 3047 B9R0.4 CCCC[C@H](C)CC(=O)O MCULE-2048808547 [0,1,1,0,0,0|1,0,0]=3 3048 B9R0.4 CCCC[C@H](N)CC(=O)O MCULE-1387096023 [0,1,1,0,0,0|1,0,0]=3 3049 B9R0.4 CCCNC(=O)CC(=O)C MCULE-2070588179 [0,1,1,0,0,0|1,0,1]=4 3050 B9R0.4 COCCN(C)CC(=O)O MCULE-2440763888 [0,1,1,0,0,0|2,0,0]=4 3051 B9R0.4 COCCN(C)CC(=O)O MCULE-6319676297 [0,1,1,0,0,0|2,0,0]=4 3052 B9R0.4 CSCCC(N)CC(=O)O MCULE-1046928513 [0,1,1,0,0,0|1,0,0]=3 3053 B9R0.4 CSCCC(N)CC(=O)O MCULE-8979030814 [0,1,1,0,0,0|1,0,0]=3 3054 B9R0.4 CSCCC(O)CC(=O)O MCULE-8328222292 [0,1,1,0,0,0|1,0,0]=3 3055 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-2765615228 [0,1,1,0,0,0|1,0,0]=3 3056 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-5262188114 [0,1,1,0,0,0|1,0,0]=3 3057 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-7951099593 [0,1,1,0,0,0|1,0,0]=3 3058 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-9117868798 [0,1,1,0,0,0|1,0,0]=3 3059 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-1875547228 [0,1,1,0,0,0|1,0,0]=3 3060 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-2149586027 [0,1,1,0,0,0|1,0,0]=3 3061 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-2492945888 [0,1,1,0,0,0|1,0,0]=3 3062 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-3229832789 [0,1,1,0,0,0|1,0,0]=3 3063 B9R0.4 NCCCC(N)CC(=O)O MCULE-3705980324 [0,1,1,0,0,0|2,0,0]=4 3064 B9R0.4 NCCCC(N)CC(=O)O MCULE-5566899547 [0,1,1,0,0,0|2,0,0]=4 3065 B9R0.4 NCCC[C@@H](N)CC(=O)O MCULE-3425525065 [0,1,1,0,0,0|2,0,0]=4 3066 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-2321041121 [0,1,1,0,0,0|2,0,0]=4 3067 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-6552199637 [0,1,1,0,0,0|2,0,0]=4 3068 B9R0.38 CCCCCCP(=O)(O)O MCULE-9622755834 [0,1,1,0,0,0|2,0,0]=4 3069 B9R0.38 CCCCCCS(=O)(=O)O MCULE-4883139983 [0,1,1,0,0,0|2,0,0]=4 3070 B9R0.38 NCCNCCS(=O)(=O)O MCULE-1404556880 [0,1,1,0,0,0|2,0,0]=4 3071 B9R0.46 C#CCCCCC(=O)OC MCULE-4261649689 [0,1,1,0,0,0|1,0,1]=4 3072 B9R0.46 C=CC(=O)CCCCCC MCULE-4486396694 [0,1,1,0,0,0|2,0,0]=4 3073 B9R0.46 C=CCCCCC(=O)OC MCULE-7317556908 [0,1,1,0,0,0|1,0,1]=4 3074 B9R0.46 C=CCNCCC(=O)OC MCULE-2549759040 [0,1,1,0,0,0|0,0,2]=4 3075 B9R0.46 CCCCCCC(=O)CBr MCULE-5041636942 [0,1,1,0,0,0|2,0,0]=4 3076 B9R0.46 CCCCCCC(=O)CC MCULE-6606139631 [0,1,1,0,0,0|2,0,0]=4 3077 B9R0.46 CCCCCCC(=O)NN MCULE-6491418749 [0,1,1,0,0,0|2,0,0]=4 3078 B9R0.46 CCCCCCC(=O)NO MCULE-7308576516 [0,1,1,0,0,0|1,0,0]=3 3079 B9R0.46 CCCCCCC(=O)OC MCULE-7883111323 [0,1,1,0,0,0|1,0,0]=3 3080 B9R0.46 CCCCSCC(=O)OC MCULE-1208944064 [0,1,1,0,0,0|2,0,0]=4 3081 B9R0.46 CCCNCCC(=O)NC MCULE-7368054577 [0,1,1,0,0,0|1,0,0]=3 3082 B9R0.46 CCCNCCC(=O)NN MCULE-5834849938 [0,1,1,0,0,0|1,0,0]=3 3083 B9R0.46 CCCNCCC(=O)OC MCULE-4786941347 [0,1,1,0,0,0|0,0,0]=2 3084 B9R0.46 CCNCCCC(=O)OC MCULE-1330024068 [0,1,1,0,0,0|2,0,0]=4 3085 B9R0.46 CCNCCCC(=O)OC MCULE-1608160566 [0,1,1,0,0,0|2,0,0]=4 3086 B9R0.46 CNCCCCC(=O)OC MCULE-3479794664 [0,1,1,0,0,0|0,0,0]=2 3087 B9R0.46 CNCCCCC(=O)OC MCULE-3875784281 [0,1,1,0,0,0|0,0,0]=2 3088 B9R0.46 COC(=O)CCCCC=O MCULE-6810055406 [0,1,1,0,0,0|2,0,0]=4 3089 B9R0.46 COC(=O)CCCCCBr MCULE-5661009403 [0,1,1,0,0,0|2,0,0]=4 3090 B9R0.46 COC(=O)CCCCCCl MCULE-2967199349 [0,1,1,0,0,0|2,0,0]=4 3091 B9R0.46 COC(=O)CCCCCI MCULE-6638103547 [0,1,1,0,0,0|2,0,0]=4 3092 B9R0.46 COC(=O)CCCCCN MCULE-9013585398 [0,1,1,0,0,0|2,0,0]=4 3093 B9R0.46 COC(=O)CCCCCN MCULE-9184696999 [0,1,1,0,0,0|2,0,0]=4 3094 B9R0.46 COC(=O)CCCCCO MCULE-6405405706 [0,1,1,0,0,0|2,0,0]=4 3095 B9R0.46 COC(=O)CCCCCS MCULE-3886120866 [0,1,1,0,0,0|2,0,0]=4 3096 B9R0.46 COC(=O)CCNCC#N MCULE-6687843428 [0,1,1,0,0,0|1,0,1]=4 3097 B9R0.46 COC(=O)CCNCCO MCULE-8673898296 [0,1,1,0,0,0|1,0,0]=3 3098 B9R0.46 COC(=O)CCNCCO MCULE-9372452891 [0,1,1,0,0,0|1,0,0]=3 3099 B9R0.46 COC(=O)CCOCCO MCULE-2103874995 [0,1,1,0,0,0|2,0,0]=4 3100 B9R0.46 COC(=O)CCSCCBr MCULE-9094494560 [0,1,1,0,0,0|2,0,0]=4 3101 B9R0.46 COCCCCC(=O)OC MCULE-9886328481 [0,1,1,0,0,0|1,0,0]=3 3102 B9R0.46 COCCNCC(=O)OC MCULE-2601282680 [0,1,1,0,0,0|2,0,0]=4 3103 B9R0.46 COCCOCC(=O)OC MCULE-4614657424 [0,1,1,0,0,0|2,0,0]=4 3104 B9R0.46 COCCSCC(=O)OC MCULE-2376910054 [0,1,1,0,0,0|2,0,0]=4 3105 B9R0.47 C#CCCC[C@@H](N)C(=O)O MCULE-1522125822 [0,1,1,0,0,0|1,0,1]=4 3106 B9R0.47 C#CCCC[C@@H](N)C(=O)O MCULE-2184948430 [0,1,1,0,0,0|1,0,1]=4 3107 B9R0.47 C#CCCC[C@H](N)C(=O)O MCULE-3478575968 [0,1,1,0,0,0|1,0,1]=4 3108 B9R0.47 C#CCCC[C@H](N)C(=O)O MCULE-5307313414 [0,1,1,0,0,0|1,0,1]=4 3109 B9R0.47 C(N)(CCCCN)C(=O)O MCULE-7060791798 [0,1,1,0,0,0|2,0,0]=4 3110 B9R0.47 C=CCCCC(N)C(=O)O MCULE-3707920281 [0,1,1,0,0,0|1,0,1]=4 3111 B9R0.47 C=CCCCC(N)C(=O)O MCULE-5939027667 [0,1,1,0,0,0|1,0,1]=4 3112 B9R0.47 C=CCCCC(N)C(=O)O MCULE-6095387409 [0,1,1,0,0,0|1,0,1]=4 3113 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-2101628204 [0,1,1,0,0,0|1,0,1]=4 3114 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-7328150693 [0,1,1,0,0,0|1,0,1]=4 3115 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-1162071877 [0,1,1,0,0,0|1,0,1]=4 3116 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-7245809917 [0,1,1,0,0,0|1,0,1]=4 3117 B9R0.47 CC(CSCCN)C(=O)O MCULE-8181129041 [0,1,1,0,0,0|2,0,0]=4 3118 B9R0.47 CC(CSCCN)C(=O)O MCULE-9927031234 [0,1,1,0,0,0|2,0,0]=4 3119 B9R0.47 CCCC=CC(O)C(=O)O MCULE-9096490162 [0,1,1,0,0,0|1,0,1]=4 3120 B9R0.47 CCCCCC(=O)C(=O)O MCULE-2334480456 [0,1,1,0,0,0|1,0,1]=4 3121 B9R0.47 CCCCCC(C)C(=O)C MCULE-8141962187 [0,1,1,0,0,0|2,0,0]=4 3122 B9R0.47 CCCCCC(C)C(=O)O MCULE-3831811055 [0,1,1,0,0,0|1,0,0]=3 3123 B9R0.47 CCCCCC(N)C(=O)O MCULE-5558679374 [0,1,1,0,0,0|1,0,0]=3 3124 B9R0.47 CCCCCC(N)C(=O)O MCULE-8607576790 [0,1,1,0,0,0|1,0,0]=3 3125 B9R0.47 CCCCCC(O)C(=O)O MCULE-4151749430 [0,1,1,0,0,0|1,0,0]=3 3126 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-3981603450 [0,1,1,0,0,0|1,0,0]=3 3127 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-6090735433 [0,1,1,0,0,0|1,0,0]=3 3128 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-8108024359 [0,1,1,0,0,0|1,0,0]=3 3129 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-9961773652 [0,1,1,0,0,0|1,0,0]=3 3130 B9R0.47 CCCCOC(C)C(=O)O MCULE-2711768240 [0,1,1,0,0,0|2,0,0]=4 3131 B9R0.47 CCCCSC(C)C(=O)O MCULE-1538375330 [0,1,1,0,0,0|2,0,0]=4 3132 B9R0.47 CCCSCC(N)C(=O)O MCULE-1465196294 [0,1,1,0,0,0|1,0,0]=3 3133 B9R0.47 CCCSCC(N)C(=O)O MCULE-2196835186 [0,1,1,0,0,0|1,0,0]=3 3134 B9R0.47 CCCSC[C@H](N)C(=O)O MCULE-2274873569 [0,1,1,0,0,0|1,0,0]=3 3135 B9R0.47 CCNCCC(N)C(=O)O MCULE-8873123795 [0,1,1,0,0,0|2,0,0]=4 3136 B9R0.47 CCSCCC(N)C(=O)O MCULE-8503033566 [0,1,1,0,0,0|2,0,0]=4 3137 B9R0.47 CCSCCC(N)C(=O)O MCULE-9465623190 [0,1,1,0,0,0|2,0,0]=4 3138 B9R0.47 CCSCC[C@@H](N)C(=O)O MCULE-2836325620 [0,1,1,0,0,0|2,0,0]=4 3139 B9R0.47 CCSCC[C@H](N)C(=O)O MCULE-6614300528 [0,1,1,0,0,0|2,0,0]=4 3140 B9R0.47 CC[Se]CCC(N)C(=O)O MCULE-7426703933 [0,1,1,0,0,0|2,0,0]=4 3141 B9R0.47 COCCCC(C)C(=O)O MCULE-7159772792 [0,1,1,0,0,0|1,0,0]=3 3142 B9R0.47 COCCNC(C)C(=O)O MCULE-1762428923 [0,1,1,0,0,0|2,0,0]=4 3143 B9R0.47 COCCNC(C)C(=O)O MCULE-8532368084 [0,1,1,0,0,0|2,0,0]=4 3144 B9R0.47 COCCOC(C)C(=O)O MCULE-5271320344 [0,1,1,0,0,0|2,0,0]=4 3145 B9R0.47 CSCCOC(C)C(=O)O MCULE-2180057271 [0,1,1,0,0,0|2,0,0]=4 3146 B9R0.47 CSCSC[C@H](N)C(=O)O MCULE-2792975111 [0,1,1,0,0,0|2,0,0]=4 3147 B9R0.47 NC(CCCCO)C(=O)O MCULE-7372730935 [0,1,1,0,0,0|2,0,0]=4 3148 B9R0.47 NC(CSCCO)C(=O)O MCULE-9765321939 [0,1,1,0,0,0|2,0,0]=4 3149 B9R0.47 NCCCCC(N)C(=O)O MCULE-1411873021 [0,1,1,0,0,0|2,0,0]=4 3150 B9R0.47 NCCCCC(N)C(=O)O MCULE-1436032977 [0,1,1,0,0,0|2,0,0]=4 3151 B9R0.47 NCCCCC(N)C(=O)O MCULE-5737537430 [0,1,1,0,0,0|2,0,0]=4 3152 B9R0.47 NCCCCC(N)C(=O)O MCULE-6537319758 [0,1,1,0,0,0|2,0,0]=4 3153 B9R0.47 NCCCCC(N)C(=O)O MCULE-9665753367 [0,1,1,0,0,0|2,0,0]=4 3154 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2051883110 [0,1,1,0,0,0|2,0,0]=4 3155 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2174845427 [0,1,1,0,0,0|2,0,0]=4 3156 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7229907816 [0,1,1,0,0,0|2,0,0]=4 3157 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7646209988 [0,1,1,0,0,0|2,0,0]=4 3158 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-1814780282 [0,1,1,0,0,0|2,0,0]=4 3159 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2585671029 [0,1,1,0,0,0|2,0,0]=4 3160 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2735109468 [0,1,1,0,0,0|2,0,0]=4 3161 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-3226089160 [0,1,1,0,0,0|2,0,0]=4 3162 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-4736099943 [0,1,1,0,0,0|2,0,0]=4 3163 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5602916309 [0,1,1,0,0,0|2,0,0]=4 3164 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5669080418 [0,1,1,0,0,0|2,0,0]=4 3165 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5771120494 [0,1,1,0,0,0|2,0,0]=4 3166 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-6467055628 [0,1,1,0,0,0|2,0,0]=4 3167 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7268734331 [0,1,1,0,0,0|2,0,0]=4 3168 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7702716758 [0,1,1,0,0,0|2,0,0]=4 3169 B9R0.47 NCCCC[C@H]([NH3+])C(=O)O MCULE-1421201563 [0,1,1,0,0,0|2,0,0]=4 3170 B9R0.47 NCCOCC(N)C(=O)O MCULE-7224841130 [0,1,1,0,0,0|2,0,0]=4 3171 B9R0.47 NCCOCC(N)C(=O)O MCULE-7654083918 [0,1,1,0,0,0|2,0,0]=4 3172 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4415047402 [0,1,1,0,0,0|2,0,0]=4 3173 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4663780920 [0,1,1,0,0,0|2,0,0]=4 3174 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4696145098 [0,1,1,0,0,0|2,0,0]=4 3175 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-9286897415 [0,1,1,0,0,0|2,0,0]=4 3176 B9R0.47 NCCSCC(N)C(=O)O MCULE-5256853681 [0,1,1,0,0,0|2,0,0]=4 3177 B9R0.47 NCCSCC(N)C(=O)O MCULE-7420723141 [0,1,1,0,0,0|2,0,0]=4 3178 B9R0.47 NCCSCC(N)C(=O)O MCULE-9409306380 [0,1,1,0,0,0|2,0,0]=4 3179 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-3159724083 [0,1,1,0,0,0|2,0,0]=4 3180 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-4836746198 [0,1,1,0,0,0|2,0,0]=4 3181 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-6032940560 [0,1,1,0,0,0|2,0,0]=4 3182 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-6994785146 [0,1,1,0,0,0|2,0,0]=4 3183 B9R0.47 NCC[Se]C[C@H](N)C(=O)O MCULE-1630938680 [0,1,1,0,0,0|2,0,0]=4 3184 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-1855458643 [0,1,1,0,0,0|2,0,0]=4 3185 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-3280637244 [0,1,1,0,0,0|2,0,0]=4 3186 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-2690192301 [0,1,1,0,0,0|1,0,0]=3 3187 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-8331389811 [0,1,1,0,0,0|1,0,0]=3 3188 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9071251692 [0,1,1,0,0,0|1,0,0]=3 3189 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9613387165 [0,1,1,0,0,0|1,0,0]=3 3190 B9R0.47 N[C@@H](CSCCO)C(=O)O MCULE-4219102659 [0,1,1,0,0,0|2,0,0]=4 3191 B9R0.47 N[C@H](CSCCO)C(=O)O MCULE-6379323435 [0,1,1,0,0,0|2,0,0]=4 3192 B9R0.47 O=C(O)C(Br)CCCCBr MCULE-9265332965 [0,1,1,0,0,0|2,0,0]=4 3193 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-2676284364 [0,1,1,0,0,0|2,0,0]=4 3194 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-3536027321 [0,1,1,0,0,0|2,0,0]=4 3195 B9R0.47 [C@H](N)(CCNCC)C(=O)O MCULE-8327043663 [0,1,1,0,0,0|2,0,0]=4 3196 B9R0.48 CCCC(=O)CCC(=O)C MCULE-2562578971 [0,1,1,0,0,0|2,0,0]=4 3197 B9R0.48 CCCC(=O)CCC(=O)O MCULE-4809633073 [0,1,1,0,0,0|1,0,0]=3 3198 B9R0.48 CCCC(=O)NCC(=O)O MCULE-1331310812 [0,1,1,0,0,0|2,0,0]=4 3199 B9R0.48 CCCC(C)CCC(=O)C MCULE-1446034135 [0,1,1,0,0,0|2,0,0]=4 3200 B9R0.48 CCCC(C)CCC(=O)O MCULE-2307170636 [0,1,1,0,0,0|1,0,0]=3 3201 B9R0.48 CCCC(Cl)CCC(=O)Cl MCULE-1887322362 [0,1,1,0,0,0|2,0,0]=4 3202 B9R0.48 CCCC(N)CCC(=O)O MCULE-2596842997 [0,1,1,0,0,0|1,0,0]=3 3203 B9R0.48 CCCC(N)CCC(=O)O MCULE-4723059719 [0,1,1,0,0,0|1,0,0]=3 3204 B9R0.48 CCCN(C)CCC(=O)O MCULE-4436694860 [0,1,1,0,0,0|0,0,0]=2 3205 B9R0.48 CCCN(C)CCC(=O)O MCULE-5636730093 [0,1,1,0,0,0|0,0,0]=2 3206 B9R0.48 CCNC(=O)CCC(=O)O MCULE-1979773964 [0,1,1,0,0,0|2,0,0]=4 3207 B9R0.48 CCOC(=O)CCC(=O)O MCULE-4329005000 [0,1,1,0,0,0|2,0,0]=4 3208 B9R0.48 CN(CCO)CCC(=O)O MCULE-1755715725 [0,1,1,0,0,0|1,0,0]=3 3209 B9R0.48 COCC(C)NCC(=O)O MCULE-1388451631 [0,1,1,0,0,0|2,0,0]=4 3210 B9R0.48 COCC(C)NCC(=O)O MCULE-8506123448 [0,1,1,0,0,0|2,0,0]=4 3211 B9R0.55 C=C(Br)CCCCC(=O)O MCULE-9413125657 [0,1,1,0,0,0|1,0,1]=4 3212 B9R0.55 C=C(C)CCCCC(=O)O MCULE-2837812117 [0,1,1,0,0,0|1,0,0]=3 3213 B9R0.55 C=C(Cl)CCCCC(=O)O MCULE-6161023222 [0,1,1,0,0,0|1,0,1]=4 3214 B9R0.55 CC(=CCCCC(=O)O)C MCULE-3753028092 [0,1,1,0,0,0|1,0,1]=4 3215 B9R0.55 CC(=O)CCCCC(=O)C MCULE-9230576763 [0,1,1,0,0,0|2,0,0]=4 3216 B9R0.55 CC(=O)CCCCC(=O)O MCULE-6216368990 [0,1,1,0,0,0|1,0,0]=3 3217 B9R0.55 CC(=O)CCCCC(C)C MCULE-8847308651 [0,1,1,0,0,0|2,0,0]=4 3218 B9R0.55 CC(=O)CCCCN(C)C MCULE-4549437072 [0,1,1,0,0,0|1,0,0]=3 3219 B9R0.55 CC(=O)CCOCC(C)C MCULE-8673860656 [0,1,1,0,0,0|2,0,0]=4 3220 B9R0.55 CC(=O)NCCCC(=O)O MCULE-3194803041 [0,1,1,0,0,0|2,0,0]=4 3221 B9R0.55 CC(=O)NCCCN(C)C MCULE-9928212719 [0,1,1,0,0,0|2,0,0]=4 3222 B9R0.55 CC(=O)OCCCC(=O)O MCULE-3807110432 [0,1,1,0,0,0|2,0,0]=4 3223 B9R0.55 CC(=O)SCCCC(=O)O MCULE-2047230148 [0,1,1,0,0,0|2,0,0]=4 3224 B9R0.55 CC(C)C=CCCC(=O)O MCULE-4916288990 [0,1,1,0,0,0|1,0,1]=4 3225 B9R0.55 CC(C)CCCCC(=O)N MCULE-5796308812 [0,1,1,0,0,0|2,0,0]=4 3226 B9R0.55 CC(C)CCCCC(=O)O MCULE-9552597130 [0,1,1,0,0,0|1,0,0]=3 3227 B9R0.55 CC(C)CCOCC(=O)O MCULE-8263995178 [0,1,1,0,0,0|2,0,0]=4 3228 B9R0.55 CC(C)CCSCC(=O)O MCULE-6718693744 [0,1,1,0,0,0|2,0,0]=4 3229 B9R0.55 CC(C)CNCCC(=O)O MCULE-7021054047 [0,1,1,0,0,0|0,0,0]=2 3230 B9R0.55 CC(C)CNCCC(=O)O MCULE-7640501484 [0,1,1,0,0,0|0,0,0]=2 3231 B9R0.55 CC(C)COCCC(=O)O MCULE-6429199224 [0,1,1,0,0,0|1,0,0]=3 3232 B9R0.55 CC(C)CSCCC(=O)O MCULE-9529480904 [0,1,1,0,0,0|1,0,0]=3 3233 B9R0.55 CC(C)NCCCC(=O)O MCULE-4053268267 [0,1,1,0,0,0|2,0,0]=4 3234 B9R0.55 CC(C)NCCCC(=O)O MCULE-8505810240 [0,1,1,0,0,0|2,0,0]=4 3235 B9R0.55 CC(C)OCCCC(=O)O MCULE-8577811101 [0,1,1,0,0,0|2,0,0]=4 3236 B9R0.55 CC(C)SCCCC(=O)O MCULE-7082519548 [0,1,1,0,0,0|2,0,0]=4 3237 B9R0.55 CC(N)CCCCC(=O)O MCULE-3306602652 [0,1,1,0,0,0|1,0,0]=3 3238 B9R0.55 CC(N)CCCCC(=O)O MCULE-3909320120 [0,1,1,0,0,0|1,0,0]=3 3239 B9R0.55 CN(C)CCCCC(=O)O MCULE-9080305665 [0,1,1,0,0,0|0,0,0]=2 3240 B9R0.55 CN(C)CCCCC(=O)O MCULE-9325797900 [0,1,1,0,0,0|0,0,0]=2 3241 B9R0.55 CN(C)CCCNC(=O)N MCULE-7609255843 [0,1,1,0,0,0|2,0,0]=4 3242 B9R0.55 CN(C)CCCNC(=O)N MCULE-8074263689 [0,1,1,0,0,0|2,0,0]=4 3243 B9R0.55 CN(C)CCNCC(=O)O MCULE-6551648059 [0,1,1,0,0,0|1,0,0]=3 3244 B9R0.55 CN(C)CCNCC(=O)O MCULE-7040720736 [0,1,1,0,0,0|1,0,0]=3 3245 B9R0.55 CN(C)CCOCC(=O)O MCULE-6117066964 [0,1,1,0,0,0|1,0,0]=3 3246 B9R0.55 CN(C)CCSCC(=O)O MCULE-5970767298 [0,1,1,0,0,0|1,0,0]=3 3247 B9R0.55 CN(C)CCSCC(=O)O MCULE-6364036095 [0,1,1,0,0,0|1,0,0]=3 3248 B9R0.55 NC(=O)CCCCC(=O)O MCULE-6793890356 [0,1,1,0,0,0|2,0,0]=4 3249 B9R0.55 O=C(O)CCCCC(=O)O MCULE-1336748609 [0,1,1,0,0,0|2,0,0]=4 3250 B9R0.55 O=C(O)CCCCC(=O)O MCULE-3664126855 [0,1,1,0,0,0|2,0,0]=4 3251 B9R0.55 O=C(O)CCCCC(=O)O MCULE-6331125687 [0,1,1,0,0,0|2,0,0]=4 3252 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7006255210 [0,1,1,0,0,0|2,0,0]=4 3253 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7155960751 [0,1,1,0,0,0|2,0,0]=4 3254 B9R0.55 O=C(O)CCCCC(F)F MCULE-4491962830 [0,1,1,0,0,0|2,0,0]=4 3255 B9R0.55 O=C(O)CCOCC(F)F MCULE-5247096062 [0,1,1,0,0,0|2,0,0]=4 3256 B9R0.55 O=C([O-])CCCCC(=O)O MCULE-3513522562 [0,1,1,0,0,0|2,0,0]=4 3257 B9R0.55 O=C([O-])CCCCC(=O)O MCULE-5232497586 [0,1,1,0,0,0|2,0,0]=4 3258 B9R0.55 O=C([O-])CCCCC(=O)O MCULE-9724137457 [0,1,1,0,0,0|2,0,0]=4 3259 B9R0.6 CCCC(C)C(N)C(=O)O MCULE-3481285649 [0,1,1,0,0,0|2,0,0]=4 3260 B9R0.6 CCCC(O)C(N)C(=O)O MCULE-5391337444 [0,1,1,0,0,0|2,0,0]=4 3261 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O MCULE-2918610954 [0,1,1,0,0,0|2,0,0]=4 3262 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O MCULE-1958502407 [0,1,1,0,0,0|2,0,0]=4 3263 B9R0.6 CCC[C@H](N)C(O)C(=O)O MCULE-8649182139 [0,1,1,0,0,0|2,0,0]=4 3264 B9R0.6 CCOC(=O)C(C)C(=O)O MCULE-8985852240 [0,1,1,0,0,0|1,0,1]=4 3265 B9R0.6 COCC(C)C(C)C(=O)O MCULE-8168198082 [0,1,1,0,0,0|2,0,0]=4 3266 B9R0.7 CC(=O)SCC(C)C(=O)O MCULE-5116238206 [0,1,1,0,0,0|1,0,1]=4 3267 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8028939364 [0,1,1,0,0,0|1,0,1]=4 3268 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O MCULE-8973266419 [0,1,1,0,0,0|1,0,1]=4 3269 B9R0.7 CC(C)CCC(C)C(=O)O MCULE-8295273403 [0,1,1,0,0,0|1,0,0]=3 3270 B9R0.7 CC(C)CCC(F)C(=O)O MCULE-1179378327 [0,1,1,0,0,0|2,0,0]=4 3271 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-1719574078 [0,1,1,0,0,0|2,0,0]=4 3272 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7494642848 [0,1,1,0,0,0|2,0,0]=4 3273 B9R0.7 CC(C)CCC(N)C(=O)O MCULE-7934601656 [0,1,1,0,0,0|2,0,0]=4 3274 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-3738071496 [0,1,1,0,0,0|2,0,0]=4 3275 B9R0.7 CC(C)CC[C@@H](N)C(=O)O MCULE-6646418122 [0,1,1,0,0,0|2,0,0]=4 3276 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-1152840736 [0,1,1,0,0,0|2,0,0]=4 3277 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-2931632246 [0,1,1,0,0,0|2,0,0]=4 3278 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-6463365282 [0,1,1,0,0,0|2,0,0]=4 3279 B9R0.7 CC(C)CC[C@H](N)C(=O)O MCULE-7649870164 [0,1,1,0,0,0|2,0,0]=4 3280 B9R0.7 CC(C)COC(C)C(=O)O MCULE-1125012565 [0,1,1,0,0,0|2,0,0]=4 3281 B9R0.7 CC(C)OC[C@H](N)C(=O)O MCULE-1578143302 [0,1,1,0,0,0|2,0,0]=4 3282 B9R0.7 CC(C)SCC(N)C(=O)O MCULE-2486867814 [0,1,1,0,0,0|2,0,0]=4 3283 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1523371907 [0,1,1,0,0,0|1,0,1]=4 3284 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1939523418 [0,1,1,0,0,0|1,0,1]=4 3285 B9R0.7 CC(CCN(C)C)C(=O)O MCULE-1367979399 [0,1,1,0,0,0|2,0,0]=4 3286 B9R0.7 CC(CCN(C)C)C(=O)O MCULE-7599864369 [0,1,1,0,0,0|2,0,0]=4 3287 B9R0.7 CC(CNC(=O)N)C(=O)O MCULE-6367938073 [0,1,1,0,0,0|1,0,1]=4 3288 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O MCULE-7515023265 [0,1,1,0,0,0|1,0,1]=4 3289 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-8441860655 [0,1,1,0,0,0|1,0,1]=4 3290 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-9071150671 [0,1,1,0,0,0|1,0,1]=4 3291 B9R0.7 C[C@H](CC[N+](=O)[O-])C(=O)O MCULE-1884928652 [0,1,1,0,0,0|2,0,0]=4 3292 B9R0.7 NC(=O)CCC(N)C(=O)O MCULE-1418655814 [0,1,1,0,0,0|1,0,1]=4 3293 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-7870225738 [0,1,1,0,0,0|1,0,1]=4 3294 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O MCULE-9711806580 [0,1,1,0,0,0|1,0,1]=4 3295 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-7234937947 [0,1,1,0,0,0|1,0,1]=4 3296 B9R0.7 NC(=O)CC[C@H](N)C(=O)O MCULE-8718820108 [0,1,1,0,0,0|1,0,1]=4 3297 B9R0.8 C(N)(CCCN)C(=O)OC MCULE-3671687930 [0,1,1,0,0,0|1,0,0]=3 3298 B9R0.8 C(N)(CCCN)C(=O)OC MCULE-7038280539 [0,1,1,0,0,0|1,0,0]=3 3299 B9R0.8 CCCCC(Br)C(=O)OC MCULE-4103872528 [0,1,1,0,0,0|2,0,0]=4 3300 B9R0.8 CCCCC(N)C(=O)OC MCULE-1230899944 [0,1,1,0,0,0|2,0,0]=4 3301 B9R0.8 CCCCC(N)C(=O)OC MCULE-8455548704 [0,1,1,0,0,0|2,0,0]=4 3302 B9R0.8 CCCCC(S)C(=O)OC MCULE-3094220494 [0,1,1,0,0,0|2,0,0]=4 3303 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-3834316771 [0,1,1,0,0,0|2,0,0]=4 3304 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-4089310144 [0,1,1,0,0,0|2,0,0]=4 3305 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-8244695684 [0,1,1,0,0,0|2,0,0]=4 3306 B9R0.8 CCCC[C@@H](N)C(=O)OC MCULE-8512513571 [0,1,1,0,0,0|2,0,0]=4 3307 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-1675626630 [0,1,1,0,0,0|2,0,0]=4 3308 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-3850807479 [0,1,1,0,0,0|2,0,0]=4 3309 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-6677668966 [0,1,1,0,0,0|2,0,0]=4 3310 B9R0.8 CCCC[C@H](N)C(=O)OC MCULE-9798725861 [0,1,1,0,0,0|2,0,0]=4 3311 B9R0.8 CCCNC(C)C(=O)OC MCULE-6800510102 [0,1,1,0,0,0|2,0,0]=4 3312 B9R0.8 CCNCC(C)C(=O)OC MCULE-6455791716 [0,1,1,0,0,0|0,0,0]=2 3313 B9R0.8 COC(=O)C(Br)CCCBr MCULE-5582617448 [0,1,1,0,0,0|2,0,0]=4 3314 B9R0.8 COC(=O)C(Br)CCCCl MCULE-9987054323 [0,1,1,0,0,0|2,0,0]=4 3315 B9R0.8 COC(=O)C(C)NCCF MCULE-3281749935 [0,1,1,0,0,0|2,0,0]=4 3316 B9R0.8 COC(=O)C(N)CCCN MCULE-6521555168 [0,1,1,0,0,0|1,0,0]=3 3317 B9R0.8 COC(=O)C(O)CCCBr MCULE-5891554758 [0,1,1,0,0,0|2,0,0]=4 3318 B9R0.8 COC(=O)N(C)CCCN MCULE-4167608498 [0,1,1,0,0,0|1,0,0]=3 3319 B9R0.8 COC(=O)N(C)CCCO MCULE-4886206070 [0,1,1,0,0,0|2,0,0]=4 3320 B9R0.8 COC(=O)[C@@H](N)CCCN MCULE-3351048688 [0,1,1,0,0,0|1,0,0]=3 3321 B9R0.8 COC(=O)[C@@H](N)CCCN MCULE-4548438838 [0,1,1,0,0,0|1,0,0]=3 3322 B9R0.8 COC(=O)[C@@H](N)CCCN MCULE-7062535738 [0,1,1,0,0,0|1,0,0]=3 3323 B9R0.8 COC(=O)[C@@H](N)CCCN MCULE-9355659419 [0,1,1,0,0,0|1,0,0]=3 3324 B9R0.8 COC(=O)[C@H](N)CCCN MCULE-2625316815 [0,1,1,0,0,0|1,0,0]=3 3325 B9R0.8 COC(=O)[C@H](N)CCCN MCULE-4715960090 [0,1,1,0,0,0|1,0,0]=3 3326 B9R0.8 COC(=O)[C@H](N)CCCN MCULE-4992114876 [0,1,1,0,0,0|1,0,0]=3 3327 B9R0.8 COC(=O)[C@H](N)CCCN MCULE-9745337815 [0,1,1,0,0,0|1,0,0]=3 3328 B9R0.13 C=CCCC(CC)C(=O)O MCULE-6019823383 [0,1,1,0,0,0|1,0,1]=4 3329 B9R0.13 CCC(CCOC)C(=O)O MCULE-9329790915 [0,1,1,0,0,0|2,0,0]=4 3330 B9R0.13 CCC(OCCO)C(=O)O MCULE-6934668694 [0,1,1,0,0,0|2,0,0]=4 3331 B9R0.13 CCCCC(CC)C(=O)C MCULE-6594996935 [0,1,1,0,0,0|2,0,0]=4 3332 B9R0.13 CCCCC(CC)C(=O)Cl MCULE-5129133966 [0,1,1,0,0,0|2,0,0]=4 3333 B9R0.13 CCCCC(CC)C(=O)N MCULE-6741704780 [0,1,1,0,0,0|2,0,0]=4 3334 B9R0.13 CCCCC(CC)C(=O)O MCULE-5686478683 [0,1,1,0,0,0|1,0,0]=3 3335 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-6405828438 [0,1,1,0,0,0|1,0,1]=4 3336 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-6841285360 [0,1,1,0,0,0|1,0,1]=4 3337 B9R0.13 CCCCC(CC)C(=O)[O-] MCULE-9345456808 [0,1,1,0,0,0|1,0,1]=4 3338 B9R0.13 CCCCC(CN)C(=O)O MCULE-6509321720 [0,1,1,0,0,0|1,0,0]=3 3339 B9R0.13 CCCCC(CO)C(=O)C MCULE-8991511326 [0,1,1,0,0,0|2,0,0]=4 3340 B9R0.13 CCCCC(CO)C(=O)O MCULE-7586035948 [0,1,1,0,0,0|1,0,0]=3 3341 B9R0.13 CCCCC(NC)C(=O)N MCULE-5960268514 [0,1,1,0,0,0|2,0,0]=4 3342 B9R0.13 CCCCC(NC)C(=O)O MCULE-1290797295 [0,1,1,0,0,0|1,0,0]=3 3343 B9R0.13 CCCCC(OC)C(=O)O MCULE-4251070702 [0,1,1,0,0,0|1,0,0]=3 3344 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-3017621334 [0,1,1,0,0,0|1,0,0]=3 3345 B9R0.13 CCCC[C@@H](CC)C(=O)O MCULE-9782965208 [0,1,1,0,0,0|1,0,0]=3 3346 B9R0.13 CCCC[C@@H](CN)C(=O)O MCULE-8769717308 [0,1,1,0,0,0|1,0,0]=3 3347 B9R0.13 CCCC[C@@H](CO)C(=O)O MCULE-4035754044 [0,1,1,0,0,0|1,0,0]=3 3348 B9R0.13 CCCC[C@H](CC)C(=O)O MCULE-7435371149 [0,1,1,0,0,0|1,0,0]=3 3349 B9R0.13 CCCC[C@H](CN)C(=O)O MCULE-3507398764 [0,1,1,0,0,0|1,0,0]=3 3350 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-1956509117 [0,1,1,0,0,0|1,0,0]=3 3351 B9R0.13 CCCC[C@H](CO)C(=O)O MCULE-3776577040 [0,1,1,0,0,0|1,0,0]=3 3352 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-2734051077 [0,1,1,0,0,0|1,0,0]=3 3353 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-3251368399 [0,1,1,0,0,0|1,0,0]=3 3354 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-5821422660 [0,1,1,0,0,0|1,0,0]=3 3355 B9R0.13 CCCC[C@H](NC)C(=O)O MCULE-6933942099 [0,1,1,0,0,0|1,0,0]=3 3356 B9R0.13 CN[C@@H](CCCN)C(=O)O MCULE-3425842174 [0,1,1,0,0,0|0,0,0]=2 3357 B9R0.13 CN[C@@H](CCCN)C(=O)O MCULE-5957010617 [0,1,1,0,0,0|0,0,0]=2 3358 B9R0.13 CN[C@@H](CCSC)C(=O)O MCULE-4656254779 [0,1,1,0,0,0|2,0,0]=4 3359 B9R0.13 CN[C@@H](CCSC)C(=O)O MCULE-9180929954 [0,1,1,0,0,0|2,0,0]=4 3360 B9R0.13 COC(CCSC)C(=O)O MCULE-2968161259 [0,1,1,0,0,0|2,0,0]=4 3361 B9R0.42 CC(CO)CC(N)C(=O)O MCULE-1659842949 [0,1,1,0,0,0|2,0,0]=4 3362 B9R0.42 CC(NC(=O)CN)C(=O)O MCULE-2027405418 [0,1,1,0,0,0|1,0,1]=4 3363 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-7167843152 [0,1,1,0,0,0|2,0,0]=4 3364 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-9225518491 [0,1,1,0,0,0|2,0,0]=4 3365 B9R0.42 CCC(=O)NC(C)C(=O)O MCULE-5488194337 [0,1,1,0,0,0|2,0,0]=4 3366 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O MCULE-5552061501 [0,1,1,0,0,0|2,0,0]=4 3367 B9R0.42 CCC(C)CC(C)C(=O)O MCULE-6856405301 [0,1,1,0,0,0|1,0,0]=3 3368 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-1321158720 [0,1,1,0,0,0|2,0,0]=4 3369 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-9833457318 [0,1,1,0,0,0|2,0,0]=4 3370 B9R0.42 CCN(C)CC(C)C(=O)O MCULE-6094320295 [0,1,1,0,0,0|0,0,0]=2 3371 B9R0.42 CCN(C)CC(C)C(=O)O MCULE-8043640135 [0,1,1,0,0,0|0,0,0]=2 3372 B9R0.42 COC(=O)CC(C)C(=O)O MCULE-5595331018 [0,1,1,0,0,0|2,0,0]=4 3373 B9R0.42 COC(=O)CC(C)C(=O)O MCULE-9262719853 [0,1,1,0,0,0|2,0,0]=4 3374 B9R0.42 COC(=O)C[C@@H](C)C(=O)O MCULE-4861767896 [0,1,1,0,0,0|2,0,0]=4 3375 B9R0.42 COC(=O)C[C@@H](C)C(=O)O MCULE-6107558545 [0,1,1,0,0,0|2,0,0]=4 3376 B9R0.42 COC(=O)C[C@H](C)C(=O)O MCULE-1205037322 [0,1,1,0,0,0|2,0,0]=4 3377 B9R0.42 COC(=O)C[C@H](C)C(=O)O MCULE-7536209773 [0,1,1,0,0,0|2,0,0]=4 3378 B9R0.42 C[C@H](NC(=O)CN)C(=O)O MCULE-2496637228 [0,1,1,0,0,0|1,0,1]=4 3379 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5617919538 [0,1,1,0,0,0|1,0,1]=4 3380 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5853178152 [0,1,1,0,0,0|1,0,1]=4 3381 B9R0.42 [C@@H](C)(NC(=O)CN)C(=O)O MCULE-7578084271 [0,1,1,0,0,0|1,0,1]=4 3382 B9R0.51 C=CCCC(C)(C)C(=O)O MCULE-1492058519 [0,1,1,0,0,0|1,0,1]=4 3383 B9R0.51 C=CCC[C@@](C)(N)C(=O)O MCULE-8852684173 [0,1,1,0,0,0|1,0,1]=4 3384 B9R0.51 C=CCC[C@](C)(N)C(=O)O MCULE-1635647275 [0,1,1,0,0,0|1,0,1]=4 3385 B9R0.51 CC(C)(CCC#N)C(=O)O MCULE-6179801954 [0,1,1,0,0,0|0,0,2]=4 3386 B9R0.51 CC(C)(CCCO)C(=O)O MCULE-8432032551 [0,1,1,0,0,0|1,0,0]=3 3387 B9R0.51 CC(C)(CCCO)C(=O)[O-] MCULE-7948640149 [0,1,1,0,0,0|1,0,1]=4 3388 B9R0.51 CC(C)(OCCO)C(=O)O MCULE-7350629526 [0,1,1,0,0,0|2,0,0]=4 3389 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-3848172930 [0,1,1,0,0,0|0,0,0]=2 3390 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-8569683447 [0,1,1,0,0,0|0,0,0]=2 3391 B9R0.51 CCCCC(C)(C)C(=O)C MCULE-3392309275 [0,1,1,0,0,0|2,0,0]=4 3392 B9R0.51 CCCCC(C)(C)C(=O)O MCULE-6533628152 [0,1,1,0,0,0|1,0,0]=3 3393 B9R0.51 CCCCC(C)(F)C(=O)O MCULE-3264455202 [0,1,1,0,0,0|1,0,0]=3 3394 B9R0.51 CCCCC(C)(O)C(=O)O MCULE-4036610380 [0,1,1,0,0,0|1,0,0]=3 3395 B9R0.51 CCCCC(F)(F)C(=O)O MCULE-3383573238 [0,1,1,0,0,0|2,0,0]=4 3396 B9R0.51 CCOCC(C)(C)C(=O)O MCULE-3248915686 [0,1,1,0,0,0|1,0,0]=3 3397 B9R0.51 COCCC(C)(C)C(=O)O MCULE-6792174270 [0,1,1,0,0,0|2,0,0]=4 3398 B9R0.51 COCCC(C)(N)C(=O)O MCULE-5241047385 [0,1,1,0,0,0|2,0,0]=4 3399 B9R0.12 C#CCC(CC)C(=O)OC MCULE-6135533940 [0,1,1,0,0,0|1,0,1]=4 3400 B9R0.12 CCCC(NC)C(=O)OC MCULE-1157341941 [0,1,1,0,0,0|2,0,0]=4 3401 B9R0.12 CCOC(CBr)C(=O)OC MCULE-6666693930 [0,1,1,0,0,0|2,0,0]=4 3402 B9R0.12 CNC(COC)C(=O)OC MCULE-6909479011 [0,1,1,0,0,0|2,0,0]=4 3403 B9R0.12 COCC(OC)C(=O)OC MCULE-3132961231 [0,1,1,0,0,0|2,0,0]=4 3404 B9R0.15 C=CCC(CCC)C(=O)O MCULE-5379398676 [0,1,1,0,0,0|1,0,0]=3 3405 B9R0.15 CCC=C(CCC)C(=O)O MCULE-6379126755 [0,1,1,0,0,0|1,0,1]=4 3406 B9R0.15 CCCC(CCC)C(=O)C MCULE-3853377484 [0,1,1,0,0,0|2,0,0]=4 3407 B9R0.15 CCCC(CCC)C(=O)Cl MCULE-4979211332 [0,1,1,0,0,0|2,0,0]=4 3408 B9R0.15 CCCC(CCC)C(=O)N MCULE-7316825141 [0,1,1,0,0,0|2,0,0]=4 3409 B9R0.15 CCCC(CCC)C(=O)O MCULE-7136317196 [0,1,1,0,0,0|1,0,0]=3 3410 B9R0.15 CCCC(CCC)C(=O)[O-] MCULE-4799083200 [0,1,1,0,0,0|1,0,1]=4 3411 B9R0.15 CCCC(NC=O)C(=O)O MCULE-7516123408 [0,1,1,0,0,0|1,0,1]=4 3412 B9R0.15 CCCC(OCC)C(=O)O MCULE-7197686501 [0,1,1,0,0,0|1,0,0]=3 3413 B9R0.15 CCCC(SCC)C(=O)[O-] MCULE-3750013296 [0,1,1,0,0,0|1,0,1]=4 3414 B9R0.15 CCCC(SCC)C(=O)[O-] MCULE-5882369366 [0,1,1,0,0,0|1,0,1]=4 3415 B9R0.15 CCNC(CCN)C(=O)N MCULE-3086906812 [0,1,1,0,0,0|2,0,0]=4 3416 B9R0.15 CCOC(OCC)C(=O)O MCULE-9319913793 [0,1,1,0,0,0|2,0,0]=4 3417 B9R0.15 COCC(COC)C(=O)O MCULE-6082875325 [0,1,1,0,0,0|1,0,0]=3 3418 B9R0.15 NCCC(CCN)C(=O)O MCULE-3747615668 [0,1,1,0,0,0|1,0,0]=3 3419 B9R0.15 NCCC(CCN)C(=O)O MCULE-8055618051 [0,1,1,0,0,0|1,0,0]=3 3420 B9R0.29 CCC(C(=O)O)C(=O)OC MCULE-1272120302 [0,1,1,0,0,0|1,0,1]=4 3421 B9R0.29 CCC(C(=O)O)N(C)CC MCULE-1956799237 [0,1,1,0,0,0|2,0,0]=4 3422 B9R0.29 CCC(C)C(CC)C(=O)N MCULE-4344033333 [0,1,1,0,0,0|2,0,0]=4 3423 B9R0.29 CCC(C)C(NC)C(=O)O MCULE-1957885665 [0,1,1,0,0,0|2,0,0]=4 3424 B9R0.29 CCC(C)C(OC)C(=O)O MCULE-7966384544 [0,1,1,0,0,0|2,0,0]=4 3425 B9R0.29 CC[C@@H](C)[C@H](NC)C(=O)O MCULE-8364477291 [0,1,1,0,0,0|2,0,0]=4 3426 B9R0.29 CC[C@H](C)[C@@H](CC)C(=O)N MCULE-3247505890 [0,1,1,0,0,0|2,0,0]=4 3427 B9R0.29 CC[C@H](C)[C@@H](NC)C(=O)O MCULE-6136891317 [0,1,1,0,0,0|2,0,0]=4 3428 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-1871065287 [0,1,1,0,0,0|2,0,0]=4 3429 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-3891615565 [0,1,1,0,0,0|2,0,0]=4 3430 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-9489341112 [0,1,1,0,0,0|2,0,0]=4 3431 B9R0.29 COC(C)C(OC)C(=O)O MCULE-8500320405 [0,1,1,0,0,0|2,0,0]=4 3432 B9R0.29 [C@H](C)(CC)[C@H](NC)C(=O)O MCULE-1663789159 [0,1,1,0,0,0|2,0,0]=4 3433 B9R0.33 C=CCC(C(=O)O)C(C)C MCULE-6557819980 [0,1,1,0,0,0|1,0,1]=4 3434 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-5177043751 [0,1,1,0,0,0|2,0,0]=4 3435 B9R0.33 CC(C)C(CCN)C(=O)O MCULE-7075545898 [0,1,1,0,0,0|2,0,0]=4 3436 B9R0.33 CCCC(C(=O)O)C(=O)O MCULE-5699074158 [0,1,1,0,0,0|1,0,1]=4 3437 B9R0.33 CCCC(C(=O)O)C(C)C MCULE-9298455866 [0,1,1,0,0,0|1,0,0]=3 3438 B9R0.33 CCCC(C(=O)O)N(C)C MCULE-1361270877 [0,1,1,0,0,0|2,0,0]=4 3439 B9R0.33 CCC[C@@H](C(=O)O)N(C)C MCULE-5821588618 [0,1,1,0,0,0|2,0,0]=4 3440 B9R0.33 CCC[C@@H](C(=O)O)N(C)C MCULE-6045614611 [0,1,1,0,0,0|2,0,0]=4 3441 B9R0.33 CCC[C@H](C(=O)O)N(C)C MCULE-3627937276 [0,1,1,0,0,0|2,0,0]=4 3442 B9R0.33 CCC[C@H](C(=O)O)N(C)C MCULE-6264285545 [0,1,1,0,0,0|2,0,0]=4 3443 B9R0.33 CCNC(C(=O)O)C(C)C MCULE-2742420034 [0,1,1,0,0,0|2,0,0]=4 3444 B9R0.33 CCNC(C(=O)O)C(C)C MCULE-6750636271 [0,1,1,0,0,0|2,0,0]=4 3445 B9R0.33 CCOC(C(=O)O)C(C)C MCULE-7127552205 [0,1,1,0,0,0|2,0,0]=4 3446 B9R0.33 CCSC(C(=O)O)C(C)C MCULE-3558131875 [0,1,1,0,0,0|2,0,0]=4 3447 B9R0.33 COCC(C(=O)O)N(C)C MCULE-4810605036 [0,1,1,0,0,0|2,0,0]=4 3448 B9R0.33 COCC(C(=O)O)N(C)C MCULE-7502849046 [0,1,1,0,0,0|2,0,0]=4 3449 B9R0.39 CC(C)CC(C#N)C(=O)O MCULE-2645522679 [0,1,1,0,0,0|0,0,2]=4 3450 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-3679366313 [0,1,1,0,0,0|0,0,0]=2 3451 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-4357118038 [0,1,1,0,0,0|0,0,0]=2 3452 B9R0.39 CC(C)CC(CN)C(=O)O MCULE-5464779902 [0,1,1,0,0,0|0,0,0]=2 3453 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-1199418849 [0,1,1,0,0,0|0,0,0]=2 3454 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-2007636867 [0,1,1,0,0,0|0,0,0]=2 3455 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-3151357434 [0,1,1,0,0,0|0,0,0]=2 3456 B9R0.39 CC(C)C[C@@H](CN)C(=O)O MCULE-6826376648 [0,1,1,0,0,0|0,0,0]=2 3457 B9R0.39 CC(C)C[C@@H](CO)C(=O)O MCULE-8614733501 [0,1,1,0,0,0|1,0,0]=3 3458 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-1897946062 [0,1,1,0,0,0|0,0,0]=2 3459 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5204739284 [0,1,1,0,0,0|0,0,0]=2 3460 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-5587093761 [0,1,1,0,0,0|0,0,0]=2 3461 B9R0.39 CC(C)C[C@H](CN)C(=O)O MCULE-6247275234 [0,1,1,0,0,0|0,0,0]=2 3462 B9R0.39 CC(C)C[C@H](CO)C(=O)O MCULE-3078607450 [0,1,1,0,0,0|1,0,0]=3 3463 B9R0.39 CCC(CC(=O)O)C(=O)O MCULE-6275256194 [0,1,1,0,0,0|2,0,0]=4 3464 B9R0.39 CCC(CC(C)C)C(=O)O MCULE-5215518236 [0,1,1,0,0,0|1,0,0]=3 3465 B9R0.39 CCC(CC(F)F)C(=O)O MCULE-2440123997 [0,1,1,0,0,0|2,0,0]=4 3466 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-1309294109 [0,1,1,0,0,0|2,0,0]=4 3467 B9R0.39 CCC(NC(=O)C)C(=O)O MCULE-9698129539 [0,1,1,0,0,0|2,0,0]=4 3468 B9R0.39 CCC(NC(C)C)C(=O)O MCULE-7235932783 [0,1,1,0,0,0|2,0,0]=4 3469 B9R0.39 CCC(NC(C)C)C(=O)O MCULE-7934342287 [0,1,1,0,0,0|2,0,0]=4 3470 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-4606830483 [0,1,1,0,0,0|2,0,0]=4 3471 B9R0.39 CC[C@@H](NC(=O)C)C(=O)O MCULE-7396715663 [0,1,1,0,0,0|2,0,0]=4 3472 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-4940999271 [0,1,1,0,0,0|2,0,0]=4 3473 B9R0.39 CNC(CC(C)C)C(=O)O MCULE-7266045564 [0,1,1,0,0,0|2,0,0]=4 3474 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-2758691344 [0,1,1,0,0,0|2,0,0]=4 3475 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-3349649810 [0,1,1,0,0,0|2,0,0]=4 3476 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-4487326533 [0,1,1,0,0,0|2,0,0]=4 3477 B9R0.39 CN[C@@H](CC(C)C)C(=O)O MCULE-7740057854 [0,1,1,0,0,0|2,0,0]=4 3478 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2279011654 [0,1,1,0,0,0|2,0,0]=4 3479 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2290136385 [0,1,1,0,0,0|2,0,0]=4 3480 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-2552934491 [0,1,1,0,0,0|2,0,0]=4 3481 B9R0.39 CN[C@H](CC(C)C)C(=O)O MCULE-8319051174 [0,1,1,0,0,0|2,0,0]=4 3482 B9R0.39 COC(CC(C)C)C(=O)O MCULE-4497994493 [0,1,1,0,0,0|2,0,0]=4 3483 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-1683659350 [0,1,1,0,0,0|1,0,1]=4 3484 B9R0.39 NCC(CC(=O)O)C(=O)O MCULE-8428141166 [0,1,1,0,0,0|1,0,1]=4 3485 B9R0.74 CCC(N)(COC)C(=O)O MCULE-1112258412 [0,1,1,0,0,0|1,0,0]=3 3486 B9R0.74 CCC(N)(COC)C(=O)O MCULE-3146530110 [0,1,1,0,0,0|1,0,0]=3 3487 B9R0.74 CCCC(C)(CC)C(=O)C MCULE-3275508969 [0,1,1,0,0,0|2,0,0]=4 3488 B9R0.74 CCCC(C)(CC)C(=O)O MCULE-2557760328 [0,1,1,0,0,0|1,0,0]=3 3489 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-2758260935 [0,1,1,0,0,0|1,0,0]=3 3490 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-6297600490 [0,1,1,0,0,0|1,0,0]=3 3491 B9R0.74 CNC(C)(COC)C(=O)O MCULE-1951800408 [0,1,1,0,0,0|2,0,0]=4 3492 B9R0.74 CNC(C)(COC)C(=O)O MCULE-6037506715 [0,1,1,0,0,0|2,0,0]=4 3493 B9R0.74 COCC(C)(OC)C(=O)O MCULE-5307101549 [0,1,1,0,0,0|2,0,0]=4 3494 B9R1.1 C=C[C@H]1CC[C@@H](CC1)C MCULE-5121440754 [1,1,0,0,0,0|2,0,0]=4 3495 B9R1.1 CC1=CCC(CC1)C=O MCULE-5534930691 [1,1,0,0,0,0|1,0,1]=4 3496 B9R1.1 CC1CCC(CC1)C=O MCULE-9251304568 [1,1,0,0,0,0|1,0,0]=3 3497 B9R1.1 CC1CCC(CC1)CO MCULE-4775289633 [1,1,0,0,0,0|1,0,1]=4 3498 B9R1.1 CC1CCC(CN1)C#N MCULE-5465530876 [1,1,0,0,0,0|1,0,1]=4 3499 B9R1.1 CC1CCC(CN1)C#N MCULE-5656204098 [1,1,0,0,0,0|1,0,1]=4 3500 B9R1.1 CC1CCC(CN1)CO MCULE-4885325889 [1,1,0,0,0,0|0,0,1]=3 3501 B9R1.1 CC1CCC(CN1)CO MCULE-7825916156 [1,1,0,0,0,0|0,0,1]=3 3502 B9R1.1 CC1CNC(CN1)CO MCULE-1614236035 [1,1,0,0,0,0|1,0,1]=4 3503 B9R1.1 CC1CNC(CN1)CO MCULE-5390030755 [1,1,0,0,0,0|1,0,1]=4 3504 B9R1.1 CC1CNC(CN1)CO MCULE-9969171906 [1,1,0,0,0,0|1,0,1]=4 3505 B9R1.1 CC1COC(CN1)CO MCULE-1554968868 [1,1,0,0,0,0|1,0,1]=4 3506 B9R1.1 CCC1CCC(NC1)C MCULE-9037446160 [1,1,0,0,0,0|1,0,1]=4 3507 B9R1.1 CN1CCC(CC1)C=O MCULE-8279393086 [1,1,0,0,0,0|2,0,0]=4 3508 B9R1.1 CN1CCC(CC1)C=O MCULE-9128415748 [1,1,0,0,0,0|2,0,0]=4 3509 B9R1.1 COC1CCC(NC1)C MCULE-9387169751 [1,1,0,0,0,0|2,0,0]=4 3510 B9R1.1 C[C@@H]1CC[C@@H](CN1)C#N MCULE-3340382347 [1,1,0,0,0,0|1,0,1]=4 3511 B9R1.1 C[C@@H]1CC[C@@H](CN1)C#N MCULE-7218185509 [1,1,0,0,0,0|1,0,1]=4 3512 B9R1.1 C[C@@H]1CC[C@H](CN1)CO MCULE-5971217485 [1,1,0,0,0,0|0,0,1]=3 3513 B9R1.1 C[C@@H]1CC[C@H](CN1)CO MCULE-6553308509 [1,1,0,0,0,0|0,0,1]=3 3514 B9R1.1 C[C@@H]1CC[C@H](CN1)CO MCULE-8196926230 [1,1,0,0,0,0|0,0,1]=3 3515 B9R1.1 C[C@@H]1CN[C@@H](CN1)CO MCULE-1352735683 [1,1,0,0,0,0|1,0,1]=4 3516 B9R1.1 C[C@@H]1CN[C@@H](CN1)CO MCULE-9858180760 [1,1,0,0,0,0|1,0,1]=4 3517 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-1821680880 [1,1,0,0,0,0|1,0,1]=4 3518 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-3362911354 [1,1,0,0,0,0|1,0,1]=4 3519 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-5387806502 [1,1,0,0,0,0|1,0,1]=4 3520 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-5622504658 [1,1,0,0,0,0|1,0,1]=4 3521 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-8906918574 [1,1,0,0,0,0|1,0,1]=4 3522 B9R1.1 C[C@@H]1CN[C@H](CN1)CO MCULE-9114523826 [1,1,0,0,0,0|1,0,1]=4 3523 B9R1.1 C[C@H]1CC[C@@H](CC1)C=O MCULE-9199101836 [1,1,0,0,0,0|1,0,0]=3 3524 B9R1.1 C[C@H]1CC[C@@H](CC1)CO MCULE-1712721816 [1,1,0,0,0,0|1,0,1]=4 3525 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-2400500497 [1,1,0,0,0,0|1,0,1]=4 3526 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-7171157535 [1,1,0,0,0,0|1,0,1]=4 3527 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-8185817505 [1,1,0,0,0,0|1,0,1]=4 3528 B9R1.1 C[C@H]1CC[C@@H](CN1)C#N MCULE-8610394671 [1,1,0,0,0,0|1,0,1]=4 3529 B9R1.1 C[C@H]1CC[C@H](CC1)CO MCULE-8606500963 [1,1,0,0,0,0|1,0,1]=4 3530 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-1261345487 [1,1,0,0,0,0|0,0,1]=3 3531 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-5775202289 [1,1,0,0,0,0|0,0,1]=3 3532 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-6083345009 [1,1,0,0,0,0|0,0,1]=3 3533 B9R1.1 C[C@H]1CC[C@H](CN1)CO MCULE-6509601128 [1,1,0,0,0,0|0,0,1]=3 3534 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-3337276228 [1,1,0,0,0,0|1,0,1]=4 3535 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-4042671077 [1,1,0,0,0,0|1,0,1]=4 3536 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-4706980610 [1,1,0,0,0,0|1,0,1]=4 3537 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-6668546612 [1,1,0,0,0,0|1,0,1]=4 3538 B9R1.1 C[C@H]1CN[C@@H](CN1)CO MCULE-7908897272 [1,1,0,0,0,0|1,0,1]=4 3539 B9R1.1 NC1CCC(CC1)CO MCULE-2058020777 [1,1,0,0,0,0|1,0,1]=4 3540 B9R1.1 NC1CCC(CC1)CO MCULE-9932194679 [1,1,0,0,0,0|1,0,1]=4 3541 B9R1.1 N[C@H]1CC[C@@H](CC1)CO MCULE-3217313684 [1,1,0,0,0,0|1,0,1]=4 3542 B9R1.1 N[C@H]1CC[C@@H](CC1)CO MCULE-5128673214 [1,1,0,0,0,0|1,0,1]=4 3543 B9R1.1 N[C@H]1CC[C@H](CC1)CO MCULE-4030751832 [1,1,0,0,0,0|1,0,1]=4 3544 B9R1.1 N[C@H]1CC[C@H](CC1)CO MCULE-7261455396 [1,1,0,0,0,0|1,0,1]=4 3545 B9R1.1 O=C1CCC(CN1)CO MCULE-5019571847 [1,1,0,0,0,0|0,0,2]=4 3546 B9R1.1 O=CC1CCC(=O)CC1 MCULE-3607149578 [1,1,0,0,0,0|1,0,1]=4 3547 B9R1.1 O=CC1CCC(CC1)F MCULE-3555774319 [1,1,0,0,0,0|1,0,0]=3 3548 B9R1.1 O=CN1CCC(CC1)O MCULE-1725659935 [1,1,0,0,0,0|2,0,0]=4 3549 B9R1.1 OCC1CCC(CC1)F MCULE-9846629385 [1,1,0,0,0,0|1,0,1]=4 3550 B9R1.1 OCC1CCC(CC1)O MCULE-2821884453 [1,1,0,0,0,0|1,0,1]=4 3551 B9R1.1 OC[C@H]1CC[C@@H](CC1)O MCULE-4903112146 [1,1,0,0,0,0|1,0,1]=4 3552 B9R1.1 OC[C@H]1CC[C@H](CC1)O MCULE-5364161264 [1,1,0,0,0,0|1,0,1]=4 3553 B9R1.1 [C@@H]1(CC[C@H](NC1)C)C#N MCULE-7888499669 [1,1,0,0,0,0|1,0,1]=4 3554 B9R1.1 [C@@H]1(CC[C@H](NC1)C)C#N MCULE-8170462123 [1,1,0,0,0,0|1,0,1]=4 3555 B9R1.2 C1(CCCN(C1)C)CN MCULE-2271262657 [1,1,0,0,0,0|1,0,1]=4 3556 B9R1.2 C1(CCCN(C1)C)CN MCULE-8286462374 [1,1,0,0,0,0|1,0,1]=4 3557 B9R1.2 C1(CCCN(C1)C)CO MCULE-7393298394 [1,1,0,0,0,0|0,0,1]=3 3558 B9R1.2 C=C1CC(CCO1)C=O MCULE-3057874524 [1,1,0,0,0,0|2,0,0]=4 3559 B9R1.2 C=CC1CCCC(=O)C1 MCULE-4962666890 [1,1,0,0,0,0|2,0,0]=4 3560 B9R1.2 C=CC1CCCN(C1)C MCULE-3504057822 [1,1,0,0,0,0|1,0,0]=3 3561 B9R1.2 C=CC1CCCN(C1)C MCULE-6214803958 [1,1,0,0,0,0|1,0,0]=3 3562 B9R1.2 CC1CC(CCO1)C=O MCULE-4627853236 [1,1,0,0,0,0|2,0,0]=4 3563 B9R1.2 CC1CCCC(C1)C=O MCULE-8003239715 [1,1,0,0,0,0|1,0,0]=3 3564 B9R1.2 CC1CCCC(C1)CO MCULE-5618525751 [1,1,0,0,0,0|1,0,1]=4 3565 B9R1.2 CC1CNCC(C1)CO MCULE-1604083581 [1,1,0,0,0,0|0,0,1]=3 3566 B9R1.2 CC1CNCC(O1)CO MCULE-6915504187 [1,1,0,0,0,0|1,0,1]=4 3567 B9R1.2 CN1CCCC(C1)C#N MCULE-4380670930 [1,1,0,0,0,0|1,0,1]=4 3568 B9R1.2 CN1CCCC(C1)C=O MCULE-8355946906 [1,1,0,0,0,0|0,0,0]=2 3569 B9R1.2 CN1CCCC(C1)CBr MCULE-2188601392 [1,1,0,0,0,0|1,0,1]=4 3570 B9R1.2 CN1CCCC(C1)CBr MCULE-8416104252 [1,1,0,0,0,0|1,0,1]=4 3571 B9R1.2 CN1CCCC(C1)CCl MCULE-9072621944 [1,1,0,0,0,0|1,0,1]=4 3572 B9R1.2 CN1CCCC(C1)CCl MCULE-9082077674 [1,1,0,0,0,0|1,0,1]=4 3573 B9R1.2 CN1CCCC(C1)CI MCULE-6139756055 [1,1,0,0,0,0|1,0,1]=4 3574 B9R1.2 CN1CCCC(C1)CN MCULE-2577219370 [1,1,0,0,0,0|1,0,1]=4 3575 B9R1.2 CN1CCCC(C1)CN MCULE-8304464940 [1,1,0,0,0,0|1,0,1]=4 3576 B9R1.2 CN1CCCC(C1)CO MCULE-1489029640 [1,1,0,0,0,0|0,0,1]=3 3577 B9R1.2 CN1CCC[C@@H](C1)CBr MCULE-4380599715 [1,1,0,0,0,0|1,0,1]=4 3578 B9R1.2 CN1CCC[C@@H](C1)CBr MCULE-9642300938 [1,1,0,0,0,0|1,0,1]=4 3579 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-1159146844 [1,1,0,0,0,0|1,0,1]=4 3580 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-2312161748 [1,1,0,0,0,0|1,0,1]=4 3581 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-4996339542 [1,1,0,0,0,0|1,0,1]=4 3582 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-9830055203 [1,1,0,0,0,0|1,0,1]=4 3583 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-7399583774 [1,1,0,0,0,0|0,0,1]=3 3584 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-9308847454 [1,1,0,0,0,0|0,0,1]=3 3585 B9R1.2 CN1CCC[C@H](C1)CN MCULE-4714048215 [1,1,0,0,0,0|1,0,1]=4 3586 B9R1.2 CN1CCC[C@H](C1)CN MCULE-7433181082 [1,1,0,0,0,0|1,0,1]=4 3587 B9R1.2 CN1CCC[C@H](C1)CN MCULE-7796559163 [1,1,0,0,0,0|1,0,1]=4 3588 B9R1.2 CN1CCC[C@H](C1)CN MCULE-8440296789 [1,1,0,0,0,0|1,0,1]=4 3589 B9R1.2 CN1CCC[C@H](C1)CO MCULE-1288636914 [1,1,0,0,0,0|0,0,1]=3 3590 B9R1.2 CN1CCC[C@H](C1)CO MCULE-7586480861 [1,1,0,0,0,0|0,0,1]=3 3591 B9R1.2 CN1CCNC(C1)CO MCULE-8532368493 [1,1,0,0,0,0|1,0,1]=4 3592 B9R1.2 CN1CCNC(C1)CO MCULE-9785700847 [1,1,0,0,0,0|1,0,1]=4 3593 B9R1.2 CN1CCN[C@H](C1)CO MCULE-1037396112 [1,1,0,0,0,0|1,0,1]=4 3594 B9R1.2 CN1CCN[C@H](C1)CO MCULE-4462296258 [1,1,0,0,0,0|1,0,1]=4 3595 B9R1.2 CN1CCOC(C1)CO MCULE-2306737561 [1,1,0,0,0,0|1,0,1]=4 3596 B9R1.2 CN1CCOC(C1)CO MCULE-7568948293 [1,1,0,0,0,0|1,0,1]=4 3597 B9R1.2 CN1CCO[C@@H](C1)CO MCULE-1798451024 [1,1,0,0,0,0|1,0,1]=4 3598 B9R1.2 CN1CCO[C@@H](C1)CO MCULE-3962856755 [1,1,0,0,0,0|1,0,1]=4 3599 B9R1.2 CN1CCO[C@H](C1)CO MCULE-1402976006 [1,1,0,0,0,0|1,0,1]=4 3600 B9R1.2 CN1CCO[C@H](C1)CO MCULE-5169286559 [1,1,0,0,0,0|1,0,1]=4 3601 B9R1.2 CNC1CCCN(C1)C MCULE-4068190862 [1,1,0,0,0,0|2,0,0]=4 3602 B9R1.2 CNC1CCCN(C1)C MCULE-4521408673 [1,1,0,0,0,0|2,0,0]=4 3603 B9R1.2 CNC1CCCN(C1)C MCULE-6629397484 [1,1,0,0,0,0|2,0,0]=4 3604 B9R1.2 CNC1CCCN(C1)C MCULE-6885069657 [1,1,0,0,0,0|2,0,0]=4 3605 B9R1.2 CNC1CCCN(C1)C MCULE-7441151242 [1,1,0,0,0,0|2,0,0]=4 3606 B9R1.2 CN[C@@H]1CCCN(C1)C MCULE-2062827853 [1,1,0,0,0,0|2,0,0]=4 3607 B9R1.2 CN[C@@H]1CCCN(C1)C MCULE-2843210772 [1,1,0,0,0,0|2,0,0]=4 3608 B9R1.2 CN[C@@H]1CCCN(C1)C MCULE-8246618660 [1,1,0,0,0,0|2,0,0]=4 3609 B9R1.2 CN[C@H]1CCCN(C1)C MCULE-5044771299 [1,1,0,0,0,0|2,0,0]=4 3610 B9R1.2 CN[C@H]1CCCN(C1)C MCULE-5232747362 [1,1,0,0,0,0|2,0,0]=4 3611 B9R1.2 CN[C@H]1CCCN(C1)C MCULE-9523179629 [1,1,0,0,0,0|2,0,0]=4 3612 B9R1.2 CN[C@H]1CCCN(C1)C MCULE-9614537949 [1,1,0,0,0,0|2,0,0]=4 3613 B9R1.2 COC1CCCN(C1)N MCULE-4255203590 [1,1,0,0,0,0|2,0,0]=4 3614 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-4030187082 [1,1,0,0,0,0|1,0,1]=4 3615 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-8521542499 [1,1,0,0,0,0|1,0,1]=4 3616 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6331587635 [1,1,0,0,0,0|1,0,1]=4 3617 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6791243811 [1,1,0,0,0,0|1,0,1]=4 3618 B9R1.2 NC1CCCC(C1)CO MCULE-1724466395 [1,1,0,0,0,0|1,0,1]=4 3619 B9R1.2 NC1CCCC(C1)CO MCULE-8087216563 [1,1,0,0,0,0|1,0,1]=4 3620 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-1617324917 [1,1,0,0,0,0|1,0,1]=4 3621 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-8272213010 [1,1,0,0,0,0|1,0,1]=4 3622 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-2296534416 [1,1,0,0,0,0|1,0,1]=4 3623 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-5952407491 [1,1,0,0,0,0|1,0,1]=4 3624 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-6614147143 [1,1,0,0,0,0|1,0,1]=4 3625 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-2015163295 [1,1,0,0,0,0|1,0,1]=4 3626 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-3293475931 [1,1,0,0,0,0|1,0,1]=4 3627 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-1868841620 [1,1,0,0,0,0|1,0,1]=4 3628 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-6949082967 [1,1,0,0,0,0|1,0,1]=4 3629 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-9275476449 [1,1,0,0,0,0|1,0,1]=4 3630 B9R1.2 O=C1CCCC(C1)CO MCULE-5732276352 [1,1,0,0,0,0|1,0,1]=4 3631 B9R1.2 O=C1CCC[C@H](C1)CO MCULE-7659844168 [1,1,0,0,0,0|1,0,1]=4 3632 B9R1.2 O=CC1CCNC(C1)Br MCULE-8861349259 [1,1,0,0,0,0|2,0,0]=4 3633 B9R1.2 OCC1CNCC(C1)F MCULE-4143657441 [1,1,0,0,0,0|0,0,1]=3 3634 B9R1.2 OCC1CNCC(C1)F MCULE-8277902234 [1,1,0,0,0,0|0,0,1]=3 3635 B9R1.2 [C@H]1(CNC[C@@H](O1)CO)C MCULE-4259776230 [1,1,0,0,0,0|1,0,1]=4 3636 B9R1.8 BrCCC1CCCNC1 MCULE-2519817553 [1,1,0,0,0,0|1,0,1]=4 3637 B9R1.8 BrCCC1CCCNC1 MCULE-7320613897 [1,1,0,0,0,0|1,0,1]=4 3638 B9R1.8 C#CCC1CCCNC1 MCULE-1866962943 [1,1,0,0,0,0|1,0,1]=4 3639 B9R1.8 C#CCC1CCCNC1 MCULE-6673770640 [1,1,0,0,0,0|1,0,1]=4 3640 B9R1.8 C=C=CC1CCCCC1 MCULE-4177395050 [1,1,0,0,0,0|2,0,0]=4 3641 B9R1.8 C=CCC1CCCCC1 MCULE-6299666608 [1,1,0,0,0,0|2,0,0]=4 3642 B9R1.8 C=CCC1CCCNC1 MCULE-3572005428 [1,1,0,0,0,0|1,0,0]=3 3643 B9R1.8 C=CC[C@@H]1CNCCN1 MCULE-4728437017 [1,1,0,0,0,0|2,0,0]=4 3644 B9R1.8 C=COC1CCCCC1 MCULE-5621471764 [1,1,0,0,0,0|2,0,0]=4 3645 B9R1.8 CC=CC1CCCCC1 MCULE-6836950237 [1,1,0,0,0,0|2,0,0]=4 3646 B9R1.8 CCCC1CCCNC1 MCULE-4630550411 [1,1,0,0,0,0|1,0,1]=4 3647 B9R1.8 CCCC1CCCNC1 MCULE-6458267050 [1,1,0,0,0,0|1,0,1]=4 3648 B9R1.8 CCNC1CCCNC1 MCULE-3184224037 [1,1,0,0,0,0|1,0,1]=4 3649 B9R1.8 CCNC1CCCNC1 MCULE-8130828966 [1,1,0,0,0,0|1,0,1]=4 3650 B9R1.8 CCN[C@@H]1CCCNC1 MCULE-1697574363 [1,1,0,0,0,0|1,0,1]=4 3651 B9R1.8 CCN[C@@H]1CCCNC1 MCULE-7855596165 [1,1,0,0,0,0|1,0,1]=4 3652 B9R1.8 CCOC1CCCNC1 MCULE-3782616420 [1,1,0,0,0,0|1,0,1]=4 3653 B9R1.8 CCOC1CCCNC1 MCULE-7785802954 [1,1,0,0,0,0|1,0,1]=4 3654 B9R1.8 CCO[C@H]1CCCNC1 MCULE-5762359795 [1,1,0,0,0,0|1,0,1]=4 3655 B9R1.8 CNCC1CCCNC1 MCULE-4603624281 [1,1,0,0,0,0|1,0,1]=4 3656 B9R1.8 CNCC1CCCNC1 MCULE-7471110706 [1,1,0,0,0,0|1,0,1]=4 3657 B9R1.8 CNC[C@@H]1CCCNC1 MCULE-6751100332 [1,1,0,0,0,0|1,0,1]=4 3658 B9R1.8 CNC[C@@H]1CCCNC1 MCULE-9736061388 [1,1,0,0,0,0|1,0,1]=4 3659 B9R1.8 COCC1CCCNC1 MCULE-4680480363 [1,1,0,0,0,0|0,0,1]=3 3660 B9R1.8 COCC1CCCNC1 MCULE-6787404650 [1,1,0,0,0,0|0,0,1]=3 3661 B9R1.8 COCC1CNCCN1 MCULE-4868097066 [1,1,0,0,0,0|1,0,1]=4 3662 B9R1.8 COCC1CNCCO1 MCULE-4284650075 [1,1,0,0,0,0|1,0,1]=4 3663 B9R1.8 COCC1CNCCO1 MCULE-4306480276 [1,1,0,0,0,0|1,0,1]=4 3664 B9R1.8 COCC1CNCCO1 MCULE-9238704936 [1,1,0,0,0,0|1,0,1]=4 3665 B9R1.8 COCC1CNCCO1 MCULE-9910887537 [1,1,0,0,0,0|1,0,1]=4 3666 B9R1.8 COC[C@@H]1CNCCN1 MCULE-4289401787 [1,1,0,0,0,0|1,0,1]=4 3667 B9R1.8 COC[C@@H]1CNCCN1 MCULE-4949987443 [1,1,0,0,0,0|1,0,1]=4 3668 B9R1.8 COC[C@@H]1CNCCO1 MCULE-1759320762 [1,1,0,0,0,0|1,0,1]=4 3669 B9R1.8 COC[C@@H]1CNCCO1 MCULE-3365011086 [1,1,0,0,0,0|1,0,1]=4 3670 B9R1.8 COC[C@@H]1CNCCO1 MCULE-6900505382 [1,1,0,0,0,0|1,0,1]=4 3671 B9R1.8 COC[C@@H]1CNCCO1 MCULE-8734322374 [1,1,0,0,0,0|1,0,1]=4 3672 B9R1.8 COC[C@H]1CCCNC1 MCULE-3011341019 [1,1,0,0,0,0|0,0,1]=3 3673 B9R1.8 COC[C@H]1CCCNC1 MCULE-4883513899 [1,1,0,0,0,0|0,0,1]=3 3674 B9R1.8 COC[C@H]1CCCNC1 MCULE-7083332172 [1,1,0,0,0,0|0,0,1]=3 3675 B9R1.8 COC[C@H]1CNCCO1 MCULE-1644022700 [1,1,0,0,0,0|1,0,1]=4 3676 B9R1.8 COC[C@H]1CNCCO1 MCULE-4433196291 [1,1,0,0,0,0|1,0,1]=4 3677 B9R1.8 COC[C@H]1CNCCO1 MCULE-5949615002 [1,1,0,0,0,0|1,0,1]=4 3678 B9R1.8 COC[C@H]1CNCCO1 MCULE-6997620929 [1,1,0,0,0,0|1,0,1]=4 3679 B9R1.8 CSCC1CCCNC1 MCULE-3636743256 [1,1,0,0,0,0|0,1,1]=4 3680 B9R1.8 CSCC1CCCNC1 MCULE-4931875681 [1,1,0,0,0,0|0,1,1]=4 3681 B9R1.8 FCCC1CCCNC1 MCULE-2308514802 [1,1,0,0,0,0|1,0,1]=4 3682 B9R1.8 FCCC1CCCNC1 MCULE-7436132702 [1,1,0,0,0,0|1,0,1]=4 3683 B9R1.8 N#CCC1CCCNC1 MCULE-2016270810 [1,1,0,0,0,0|1,0,1]=4 3684 B9R1.8 N#CCC1CCCNC1 MCULE-5546056159 [1,1,0,0,0,0|1,0,1]=4 3685 B9R1.8 NCCC1CCCNC1 MCULE-2317830825 [1,1,0,0,0,0|1,0,1]=4 3686 B9R1.8 NCCC1CCCNC1 MCULE-7843131930 [1,1,0,0,0,0|1,0,1]=4 3687 B9R1.8 NOCC1CCCCC1 MCULE-4119292714 [1,1,0,0,0,0|1,0,1]=4 3688 B9R1.8 NOCC1CCCCC1 MCULE-4685909729 [1,1,0,0,0,0|1,0,1]=4 3689 B9R1.8 O=C=NC1CCCCC1 MCULE-9865756478 [1,1,0,0,0,0|1,0,1]=4 3690 B9R1.8 O=CCC1CCCCC1 MCULE-1210709345 [1,1,0,0,0,0|1,0,0]=3 3691 B9R1.8 O=CCC1CCCCO1 MCULE-5585343100 [1,1,0,0,0,0|2,0,0]=4 3692 B9R1.8 O=CCC1CCCOC1 MCULE-5934314566 [1,1,0,0,0,0|1,0,0]=3 3693 B9R1.8 O=CCC1CCOCC1 MCULE-2547340776 [1,1,0,0,0,0|2,0,0]=4 3694 B9R1.8 O=CCC1CNCCO1 MCULE-6857081335 [1,1,0,0,0,0|1,0,0]=3 3695 B9R1.8 O=CCC1CNCCO1 MCULE-8149272613 [1,1,0,0,0,0|1,0,0]=3 3696 B9R1.8 O=CCN1CCCCC1 MCULE-1236885034 [1,1,0,0,0,0|2,0,0]=4 3697 B9R1.8 O=CNC1CCCCC1 MCULE-5868381758 [1,1,0,0,0,0|1,0,0]=3 3698 B9R1.8 O=CNC1CCOCC1 MCULE-2081920027 [1,1,0,0,0,0|2,0,0]=4 3699 B9R1.8 OCC=C1CCCCC1 MCULE-1575946847 [1,1,0,0,0,0|1,0,1]=4 3700 B9R1.8 OCCC1CCCCC1 MCULE-1419875265 [1,1,0,0,0,0|1,0,1]=4 3701 B9R1.8 OCCC1CCCNC1 MCULE-1585744813 [1,1,0,0,0,0|0,0,1]=3 3702 B9R1.8 OCCC1CCCNC1 MCULE-2334553785 [1,1,0,0,0,0|0,0,1]=3 3703 B9R1.8 OCCC1CCCOC1 MCULE-3721207963 [1,1,0,0,0,0|1,0,1]=4 3704 B9R1.8 OCCC1CNCCN1 MCULE-1485603248 [1,1,0,0,0,0|1,0,1]=4 3705 B9R1.8 OCCC1CNCCN1 MCULE-4527044795 [1,1,0,0,0,0|1,0,1]=4 3706 B9R1.8 OCCC1CNCCN1 MCULE-5830758261 [1,1,0,0,0,0|1,0,1]=4 3707 B9R1.8 OCCC1CNCCN1 MCULE-6879027812 [1,1,0,0,0,0|1,0,1]=4 3708 B9R1.8 OCCC1CNCCO1 MCULE-5426840446 [1,1,0,0,0,0|1,0,1]=4 3709 B9R1.8 OCCC1CNCCO1 MCULE-7364226481 [1,1,0,0,0,0|1,0,1]=4 3710 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-1010322548 [1,1,0,0,0,0|1,0,1]=4 3711 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-1682721450 [1,1,0,0,0,0|1,0,1]=4 3712 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-2510457733 [1,1,0,0,0,0|1,0,1]=4 3713 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-7412945816 [1,1,0,0,0,0|1,0,1]=4 3714 B9R1.8 OCC[C@@H]1CNCCN1 MCULE-7736283995 [1,1,0,0,0,0|1,0,1]=4 3715 B9R1.8 OCC[C@H]1CCCNC1 MCULE-7415878358 [1,1,0,0,0,0|0,0,1]=3 3716 B9R1.8 OCC[C@H]1CNCCN1 MCULE-1153840758 [1,1,0,0,0,0|1,0,1]=4 3717 B9R1.8 OCC[C@H]1CNCCN1 MCULE-2356486057 [1,1,0,0,0,0|1,0,1]=4 3718 B9R1.8 OCC[C@H]1CNCCN1 MCULE-5425698593 [1,1,0,0,0,0|1,0,1]=4 3719 B9R1.8 OCC[C@H]1CNCCN1 MCULE-7344138049 [1,1,0,0,0,0|1,0,1]=4 3720 B9R1.8 ON=CC1CCOCC1 MCULE-2877280296 [1,1,0,0,0,0|2,0,0]=4 3721 B9R1.8 ON=CC1CCOCC1 MCULE-6388122485 [1,1,0,0,0,0|2,0,0]=4 3722 B9R1.8 S=CNC1CCCCC1 MCULE-8568360220 [1,1,0,0,0,0|1,1,0]=4 3723 B9R1.15 C=CC1CCCCC1O MCULE-8134168493 [1,1,0,0,0,0|2,0,0]=4 3724 B9R1.15 CC1CC=CCC1C=O MCULE-7543573924 [1,1,0,0,0,0|1,0,1]=4 3725 B9R1.15 CC1CCCCC1C=O MCULE-5772126890 [1,1,0,0,0,0|1,0,0]=3 3726 B9R1.15 CC1CCNCC1CO MCULE-7653018616 [1,1,0,0,0,0|0,0,1]=3 3727 B9R1.15 CC1NCCCC1CO MCULE-2033869519 [1,1,0,0,0,0|0,0,1]=3 3728 B9R1.15 CN1CCCCC1C=O MCULE-8660414411 [1,1,0,0,0,0|2,0,0]=4 3729 B9R1.15 CN1CCNCC1CO MCULE-7112745401 [1,1,0,0,0,0|1,0,1]=4 3730 B9R1.15 CN1CCNCC1CO MCULE-8816850395 [1,1,0,0,0,0|1,0,1]=4 3731 B9R1.15 COC1CNCCC1C MCULE-7419288321 [1,1,0,0,0,0|2,0,0]=4 3732 B9R1.15 COC1CNCCC1C MCULE-8027196152 [1,1,0,0,0,0|2,0,0]=4 3733 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-7888271922 [1,1,0,0,0,0|2,0,0]=4 3734 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-9709371025 [1,1,0,0,0,0|2,0,0]=4 3735 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-2338099561 [1,1,0,0,0,0|2,0,0]=4 3736 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-5997296248 [1,1,0,0,0,0|2,0,0]=4 3737 B9R1.15 CO[C@@H]1CNCC[C@H]1F MCULE-8978919146 [1,1,0,0,0,0|2,0,0]=4 3738 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-2481587773 [1,1,0,0,0,0|2,0,0]=4 3739 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-8312413940 [1,1,0,0,0,0|2,0,0]=4 3740 B9R1.15 CO[C@H]1CNCC[C@@H]1F MCULE-2359199932 [1,1,0,0,0,0|2,0,0]=4 3741 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-3369664933 [1,1,0,0,0,0|2,0,0]=4 3742 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-6381125186 [1,1,0,0,0,0|2,0,0]=4 3743 B9R1.15 C[C@H]1NCCC[C@@H]1C#N MCULE-4623567710 [1,1,0,0,0,0|1,0,1]=4 3744 B9R1.15 C[C@H]1NCCC[C@@H]1C#N MCULE-5516086758 [1,1,0,0,0,0|1,0,1]=4 3745 B9R1.15 C[C@H]1NCCC[C@@H]1C#N MCULE-6468697983 [1,1,0,0,0,0|1,0,1]=4 3746 B9R1.15 C[C@H]1NCCC[C@@H]1C#N MCULE-9316935668 [1,1,0,0,0,0|1,0,1]=4 3747 B9R1.15 C[C@H]1NCCC[C@H]1CO MCULE-6295458608 [1,1,0,0,0,0|0,0,1]=3 3748 B9R1.15 NC1CCCCC1CO MCULE-5262753422 [1,1,0,0,0,0|1,0,1]=4 3749 B9R1.15 NC1CCCCC1CO MCULE-9191988425 [1,1,0,0,0,0|1,0,1]=4 3750 B9R1.15 NC1CCOCC1CO MCULE-7912086901 [1,1,0,0,0,0|1,0,1]=4 3751 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-2333094825 [1,1,0,0,0,0|1,0,1]=4 3752 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-6100111885 [1,1,0,0,0,0|1,0,1]=4 3753 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-2541489944 [1,1,0,0,0,0|1,0,1]=4 3754 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-4358798149 [1,1,0,0,0,0|1,0,1]=4 3755 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-6886498483 [1,1,0,0,0,0|1,0,1]=4 3756 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-9434700277 [1,1,0,0,0,0|1,0,1]=4 3757 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-7191404876 [1,1,0,0,0,0|1,0,1]=4 3758 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-8159159865 [1,1,0,0,0,0|1,0,1]=4 3759 B9R1.15 O=C1NCCCC1CO MCULE-3810407789 [1,1,0,0,0,0|0,0,2]=4 3760 B9R1.15 O=CC1CCCCC1=O MCULE-3775698507 [1,1,0,0,0,0|1,0,1]=4 3761 B9R1.15 OCC1CCCCC1O MCULE-1945714569 [1,1,0,0,0,0|1,0,1]=4 3762 B9R1.15 OCC1CNCCC1O MCULE-1394638729 [1,1,0,0,0,0|0,0,1]=3 3763 B9R1.15 OCC1CNCCC1O MCULE-3316949664 [1,1,0,0,0,0|0,0,1]=3 3764 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-1702794715 [1,1,0,0,0,0|0,0,1]=3 3765 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-9636833446 [1,1,0,0,0,0|0,0,1]=3 3766 B9R1.118 C=CC1(CCCCC1)O MCULE-7521116261 [1,1,0,0,0,0|2,0,0]=4 3767 B9R1.118 CC1(CCCCC1)C=O MCULE-5963131023 [1,1,0,0,0,0|1,0,0]=3 3768 B9R1.118 CC1(CCCCC1)CO MCULE-7082905261 [1,1,0,0,0,0|1,0,1]=4 3769 B9R1.118 CC1(CCCCO1)C=O MCULE-9760251174 [1,1,0,0,0,0|2,0,0]=4 3770 B9R1.118 CC1(CCCNC1)C#N MCULE-4451063330 [1,1,0,0,0,0|1,0,1]=4 3771 B9R1.118 CC1(CCCNC1)C#N MCULE-6216703132 [1,1,0,0,0,0|1,0,1]=4 3772 B9R1.118 CC1(CCCNC1)CN MCULE-1720695404 [1,1,0,0,0,0|1,0,1]=4 3773 B9R1.118 CC1(CCCNC1)CO MCULE-7859652987 [1,1,0,0,0,0|0,0,1]=3 3774 B9R1.118 CC1(CCCNC1)CO MCULE-9138617665 [1,1,0,0,0,0|0,0,1]=3 3775 B9R1.118 CC1(CCCOC1)CO MCULE-5818698089 [1,1,0,0,0,0|1,0,1]=4 3776 B9R1.118 CC1(CCOCC1)C=O MCULE-8265392725 [1,1,0,0,0,0|2,0,0]=4 3777 B9R1.118 CC1(CNCCN1)CO MCULE-1439368478 [1,1,0,0,0,0|1,0,1]=4 3778 B9R1.118 CCC1(CCCNC1)C MCULE-4065109647 [1,1,0,0,0,0|1,0,1]=4 3779 B9R1.118 CCC1(CCCNC1)C MCULE-8427718856 [1,1,0,0,0,0|1,0,1]=4 3780 B9R1.118 CCC1(CCCNC1)O MCULE-2359766186 [1,1,0,0,0,0|1,0,1]=4 3781 B9R1.118 CCC1(CCCNC1)O MCULE-4654641315 [1,1,0,0,0,0|1,0,1]=4 3782 B9R1.118 COC1(CCCNC1)C MCULE-5161551313 [1,1,0,0,0,0|2,0,0]=4 3783 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-2002234086 [1,1,0,0,0,0|0,0,1]=3 3784 B9R1.118 C[C@@]1(CCCNC1)CO MCULE-7671897310 [1,1,0,0,0,0|0,0,1]=3 3785 B9R1.118 N#CC1(CCCNC1)F MCULE-6718820857 [1,1,0,0,0,0|1,0,1]=4 3786 B9R1.118 N#CC1(CCCNC1)O MCULE-2572229172 [1,1,0,0,0,0|1,0,1]=4 3787 B9R1.118 N#CC1(CCCNC1)O MCULE-7780369642 [1,1,0,0,0,0|1,0,1]=4 3788 B9R1.118 NC1(CCCCC1)CO MCULE-5010483791 [1,1,0,0,0,0|1,0,1]=4 3789 B9R1.118 NC1(CCCCC1)CO MCULE-9568898546 [1,1,0,0,0,0|1,0,1]=4 3790 B9R1.118 O=CC1(CCOCC1)F MCULE-7250965761 [1,1,0,0,0,0|2,0,0]=4 3791 B9R1.118 O=CC1(CCSCC1)F MCULE-5821896166 [1,1,0,0,0,0|2,0,0]=4 3792 B9R1.118 O=NC1(CCCCC1)Cl MCULE-4752067659 [1,1,0,0,0,0|2,0,0]=4 3793 B9R1.118 OC1(CCCNC1)CF MCULE-8890034237 [1,1,0,0,0,0|1,0,1]=4 3794 B9R1.118 OC1(CCCNC1)CF MCULE-9294734195 [1,1,0,0,0,0|1,0,1]=4 3795 B9R1.118 OCC1(CCCCC1)F MCULE-6893319227 [1,1,0,0,0,0|1,0,1]=4 3796 B9R1.118 OCC1(CCCCC1)O MCULE-4401054903 [1,1,0,0,0,0|1,0,1]=4 3797 B9R1.118 OCC1(CCCCC1)S MCULE-4689452330 [1,1,0,0,0,0|1,0,1]=4 3798 B9R1.118 OCC1(CCCNC1)F MCULE-1604953146 [1,1,0,0,0,0|0,0,1]=3 3799 B9R1.118 OCC1(CCCNC1)F MCULE-2701254971 [1,1,0,0,0,0|0,0,1]=3 3800 B9R1.118 OCC1(CCCNC1)O MCULE-2181561679 [1,1,0,0,0,0|0,0,1]=3 3801 B9R1.118 OCC1(CCCNC1)O MCULE-5468132031 [1,1,0,0,0,0|0,0,1]=3 3802 B9R1.118 OCC1(CCCOC1)F MCULE-7902519614 [1,1,0,0,0,0|1,0,1]=4 3803 B9R1.118 OC[C@@]1(CCCNC1)F MCULE-1828463699 [1,1,0,0,0,0|0,0,1]=3 3804 B9R1.118 OC[C@]1(CCCNC1)F MCULE-1994723738 [1,1,0,0,0,0|0,0,1]=3 3805 B9R1.118 OC[C@]1(CCCNC1)F MCULE-5822647493 [1,1,0,0,0,0|0,0,1]=3 3806 B9R1.118 OC[C@]1(CCCNC1)F MCULE-6498345493 [1,1,0,0,0,0|0,0,1]=3 3807 B9R1.118 OC[C@]1(CCCNC1)F MCULE-7704795376 [1,1,0,0,0,0|0,0,1]=3 3808 B9R1.11 C#CC(=O)N1CCCC1 MCULE-1552230131 [0,1,0,0,1,0|2,0,0]=4 3809 B9R1.11 C#CC(O)C1CCCC1 MCULE-2991189926 [0,1,0,0,1,0|1,0,1]=4 3810 B9R1.11 C1(CCNC1)C(=O)OC MCULE-6356797990 [0,1,0,0,1,0|0,0,0]=2 3811 B9R1.11 C1(CCNC1)C(=O)OC MCULE-7101201723 [0,1,0,0,1,0|0,0,0]=2 3812 B9R1.11 C1(CCNC1)C(=O)OC MCULE-8951983412 [0,1,0,0,1,0|0,0,0]=2 3813 B9R1.11 C1(CCOC1)C(=O)OC MCULE-6831054690 [0,1,0,0,1,0|1,0,0]=3 3814 B9R1.11 C=CC(=O)N1CCCC1 MCULE-9314569500 [0,1,0,0,1,0|2,0,0]=4 3815 B9R1.11 C=CC(O)C1CCCC1 MCULE-8096299119 [0,1,0,0,1,0|1,0,1]=4 3816 B9R1.11 CCC(=O)C1CCCC1 MCULE-4431631098 [0,1,0,0,1,0|1,0,0]=3 3817 B9R1.11 CCC(=O)C1CCOC1 MCULE-1322014645 [0,1,0,0,1,0|2,0,0]=4 3818 B9R1.11 CCC(=O)N1CCNC1 MCULE-8872332598 [0,1,0,0,1,0|2,0,0]=4 3819 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-1661804964 [0,1,0,0,1,0|1,0,0]=3 3820 B9R1.11 CCC(=O)[C@@H]1CCCN1 MCULE-8456135152 [0,1,0,0,1,0|1,0,0]=3 3821 B9R1.11 CNC(=O)C1CCCC1 MCULE-1170525718 [0,1,0,0,1,0|1,0,0]=3 3822 B9R1.11 CNC(=O)C1CCCN1 MCULE-1783490658 [0,1,0,0,1,0|1,0,0]=3 3823 B9R1.11 CNC(=O)C1CCCN1 MCULE-5014608316 [0,1,0,0,1,0|1,0,0]=3 3824 B9R1.11 CNC(=O)C1CCNC1 MCULE-2945338804 [0,1,0,0,1,0|1,0,0]=3 3825 B9R1.11 CNC(=O)C1CCNC1 MCULE-8215086073 [0,1,0,0,1,0|1,0,0]=3 3826 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-3668444015 [0,1,0,0,1,0|1,0,0]=3 3827 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-7344672390 [0,1,0,0,1,0|1,0,0]=3 3828 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-7586915644 [0,1,0,0,1,0|1,0,0]=3 3829 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-8093231474 [0,1,0,0,1,0|1,0,0]=3 3830 B9R1.11 CNC(=O)[C@@H]1CCCN1 MCULE-9455499550 [0,1,0,0,1,0|1,0,0]=3 3831 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-1131638831 [0,1,0,0,1,0|1,0,0]=3 3832 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-4056775238 [0,1,0,0,1,0|1,0,0]=3 3833 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-4223546600 [0,1,0,0,1,0|1,0,0]=3 3834 B9R1.11 CNC(=O)[C@H]1CCCN1 MCULE-6583071684 [0,1,0,0,1,0|1,0,0]=3 3835 B9R1.11 COC(=N)C1CCCC1 MCULE-3923627958 [0,1,0,0,1,0|1,0,0]=3 3836 B9R1.11 COC(=N)C1CCCC1 MCULE-5894752285 [0,1,0,0,1,0|1,0,0]=3 3837 B9R1.11 COC(=O)C1=CCCC1 MCULE-3606282792 [0,1,0,0,1,0|0,0,2]=4 3838 B9R1.11 COC(=O)C1C=CCN1 MCULE-5230080312 [0,1,0,0,1,0|0,0,2]=4 3839 B9R1.11 COC(=O)C1C=CCN1 MCULE-8144796741 [0,1,0,0,1,0|0,0,2]=4 3840 B9R1.11 COC(=O)C1CC=CC1 MCULE-9983636796 [0,1,0,0,1,0|0,0,2]=4 3841 B9R1.11 COC(=O)C1CCCC1 MCULE-6212031690 [0,1,0,0,1,0|0,0,0]=2 3842 B9R1.11 COC(=O)C1CCCN1 MCULE-3132842932 [0,1,0,0,1,0|0,0,0]=2 3843 B9R1.11 COC(=O)C1CCCN1 MCULE-5268897425 [0,1,0,0,1,0|0,0,0]=2 3844 B9R1.11 COC(=O)C1CCCN1 MCULE-6168730709 [0,1,0,0,1,0|0,0,0]=2 3845 B9R1.11 COC(=O)C1CCCN1 MCULE-8316785654 [0,1,0,0,1,0|0,0,0]=2 3846 B9R1.11 COC(=O)C1CCCO1 MCULE-2538391455 [0,1,0,0,1,0|1,0,0]=3 3847 B9R1.11 COC(=O)C1CCCS1 MCULE-8875125328 [0,1,0,0,1,0|1,0,0]=3 3848 B9R1.11 COC(=O)C1CCNC1 MCULE-1630900792 [0,1,0,0,1,0|0,0,0]=2 3849 B9R1.11 COC(=O)C1CCNC1 MCULE-5845908055 [0,1,0,0,1,0|0,0,0]=2 3850 B9R1.11 COC(=O)C1CCNC1 MCULE-8849407954 [0,1,0,0,1,0|0,0,0]=2 3851 B9R1.11 COC(=O)C1CCOC1 MCULE-8088199992 [0,1,0,0,1,0|1,0,0]=3 3852 B9R1.11 COC(=O)C1CNC=N1 MCULE-8028237108 [0,1,0,0,1,0|1,0,1]=4 3853 B9R1.11 COC(=O)C1CSCN1 MCULE-5351052142 [0,1,0,0,1,0|1,0,0]=3 3854 B9R1.11 COC(=O)C1CSCN1 MCULE-9093296447 [0,1,0,0,1,0|1,0,0]=3 3855 B9R1.11 COC(=O)C1NCCS1 MCULE-8142325663 [0,1,0,0,1,0|1,0,0]=3 3856 B9R1.11 COC(=O)C1[NH2+]CCS1 MCULE-5863059145 [0,1,0,0,1,0|1,0,1]=4 3857 B9R1.11 COC(=O)N1CCCC1 MCULE-1240116216 [0,1,0,0,1,0|1,0,0]=3 3858 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-1869723316 [0,1,0,0,1,0|0,0,2]=4 3859 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-5370163237 [0,1,0,0,1,0|0,0,2]=4 3860 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-5818736163 [0,1,0,0,1,0|0,0,2]=4 3861 B9R1.11 COC(=O)[C@@H]1C=CCN1 MCULE-7249261083 [0,1,0,0,1,0|0,0,2]=4 3862 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-1981658590 [0,1,0,0,1,0|0,0,0]=2 3863 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-6907716746 [0,1,0,0,1,0|0,0,0]=2 3864 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-8031793722 [0,1,0,0,1,0|0,0,0]=2 3865 B9R1.11 COC(=O)[C@@H]1CCCN1 MCULE-9787777328 [0,1,0,0,1,0|0,0,0]=2 3866 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-3233941315 [0,1,0,0,1,0|0,0,0]=2 3867 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-4138957644 [0,1,0,0,1,0|0,0,0]=2 3868 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-5401828810 [0,1,0,0,1,0|0,0,0]=2 3869 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-6948701888 [0,1,0,0,1,0|0,0,0]=2 3870 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-7639173642 [0,1,0,0,1,0|0,0,0]=2 3871 B9R1.11 COC(=O)[C@@H]1CCNC1 MCULE-9871868573 [0,1,0,0,1,0|0,0,0]=2 3872 B9R1.11 COC(=O)[C@@H]1CCOC1 MCULE-2786445237 [0,1,0,0,1,0|1,0,0]=3 3873 B9R1.11 COC(=O)[C@@H]1CCOC1 MCULE-6419806426 [0,1,0,0,1,0|1,0,0]=3 3874 B9R1.11 COC(=O)[C@@H]1CSCN1 MCULE-5459284567 [0,1,0,0,1,0|1,0,0]=3 3875 B9R1.11 COC(=O)[C@@H]1CSCN1 MCULE-6009801924 [0,1,0,0,1,0|1,0,0]=3 3876 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-1925865650 [0,1,0,0,1,0|0,0,0]=2 3877 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-3950222089 [0,1,0,0,1,0|0,0,0]=2 3878 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-4251030243 [0,1,0,0,1,0|0,0,0]=2 3879 B9R1.11 COC(=O)[C@H]1CCCN1 MCULE-8974101732 [0,1,0,0,1,0|0,0,0]=2 3880 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-3002947292 [0,1,0,0,1,0|0,0,0]=2 3881 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-4023088392 [0,1,0,0,1,0|0,0,0]=2 3882 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-5206857621 [0,1,0,0,1,0|0,0,0]=2 3883 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-7688050113 [0,1,0,0,1,0|0,0,0]=2 3884 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-7976156203 [0,1,0,0,1,0|0,0,0]=2 3885 B9R1.11 COC(=O)[C@H]1CCNC1 MCULE-9431553560 [0,1,0,0,1,0|0,0,0]=2 3886 B9R1.11 COC(=O)[C@H]1CCOC1 MCULE-4215481469 [0,1,0,0,1,0|1,0,0]=3 3887 B9R1.11 COC(=O)[C@H]1CCOC1 MCULE-9152113033 [0,1,0,0,1,0|1,0,0]=3 3888 B9R1.11 N/C(=N/O)/N1CCCC1 MCULE-8007335584 [0,1,0,0,1,0|2,0,0]=4 3889 B9R1.11 N/C(=N\O)/C1CCCC1 MCULE-6643830969 [0,1,0,0,1,0|1,0,0]=3 3890 B9R1.11 N/C(=N\O)/C1CCCO1 MCULE-2644350923 [0,1,0,0,1,0|2,0,0]=4 3891 B9R1.11 N/C(=N\O)/C1CCOC1 MCULE-1870162248 [0,1,0,0,1,0|2,0,0]=4 3892 B9R1.11 NC(CO)C1CCCC1 MCULE-3542083676 [0,1,0,0,1,0|1,0,1]=4 3893 B9R1.11 NC(CO)C1CCCC1 MCULE-5931245443 [0,1,0,0,1,0|1,0,1]=4 3894 B9R1.11 NCC(=O)C1CCCC1 MCULE-2498486150 [0,1,0,0,1,0|1,0,0]=3 3895 B9R1.11 NCC(=O)C1CCCC1 MCULE-5406973286 [0,1,0,0,1,0|1,0,0]=3 3896 B9R1.11 NCC(=O)N1CCCC1 MCULE-3024051267 [0,1,0,0,1,0|2,0,0]=4 3897 B9R1.11 NCC(=O)N1CCCC1 MCULE-5492264097 [0,1,0,0,1,0|2,0,0]=4 3898 B9R1.11 NCC(=O)N1CCCC1 MCULE-9879098395 [0,1,0,0,1,0|2,0,0]=4 3899 B9R1.11 NCC(O)C1CCCC1 MCULE-1826088467 [0,1,0,0,1,0|1,0,1]=4 3900 B9R1.11 NCC(O)C1CCCC1 MCULE-5186127631 [0,1,0,0,1,0|1,0,1]=4 3901 B9R1.11 NNC(=O)C1CCCC1 MCULE-5436769120 [0,1,0,0,1,0|1,0,0]=3 3902 B9R1.11 NNC(=O)C1CCCO1 MCULE-7320789673 [0,1,0,0,1,0|2,0,0]=4 3903 B9R1.11 NNC(=O)C1CCCO1 MCULE-9371435722 [0,1,0,0,1,0|2,0,0]=4 3904 B9R1.11 NNC(=O)C1CCCS1 MCULE-3948986935 [0,1,0,0,1,0|2,0,0]=4 3905 B9R1.11 NNC(=O)C1CCOC1 MCULE-1616364111 [0,1,0,0,1,0|2,0,0]=4 3906 B9R1.11 NNC(=O)[C@@H]1CCCO1 MCULE-4678621422 [0,1,0,0,1,0|2,0,0]=4 3907 B9R1.11 NNC(=O)[C@H]1CCCO1 MCULE-2795201954 [0,1,0,0,1,0|2,0,0]=4 3908 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-1672080667 [0,1,0,0,1,0|1,0,1]=4 3909 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-2468572391 [0,1,0,0,1,0|1,0,1]=4 3910 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-9200212417 [0,1,0,0,1,0|1,0,1]=4 3911 B9R1.11 O=C(CBr)C1CCCC1 MCULE-4985111490 [0,1,0,0,1,0|1,0,0]=3 3912 B9R1.11 O=C(CBr)C1CCCO1 MCULE-9978996372 [0,1,0,0,1,0|2,0,0]=4 3913 B9R1.11 O=C(CBr)C1CCOC1 MCULE-6832037750 [0,1,0,0,1,0|2,0,0]=4 3914 B9R1.11 O=C(CBr)N1CCCC1 MCULE-2041605022 [0,1,0,0,1,0|2,0,0]=4 3915 B9R1.11 O=C(CCl)C1CCCC1 MCULE-7395779538 [0,1,0,0,1,0|1,0,0]=3 3916 B9R1.11 O=C(CCl)C1CCCN1 MCULE-3650713124 [0,1,0,0,1,0|1,0,0]=3 3917 B9R1.11 O=C(CCl)C1CCCO1 MCULE-4619044936 [0,1,0,0,1,0|2,0,0]=4 3918 B9R1.11 O=C(CCl)N1CCCC1 MCULE-3675689386 [0,1,0,0,1,0|2,0,0]=4 3919 B9R1.11 O=C(CO)N1CCCC1 MCULE-6227389604 [0,1,0,0,1,0|1,0,0]=3 3920 B9R1.11 O=C(NO)C1=CCCC1 MCULE-3789818826 [0,1,0,0,1,0|0,0,2]=4 3921 B9R1.11 O=C(NO)C1CCCC1 MCULE-3511706426 [0,1,0,0,1,0|0,0,0]=2 3922 B9R1.19 C1(CCNC1)C(C)(C)O MCULE-2335808122 [0,1,0,0,1,0|1,0,1]=4 3923 B9R1.19 C1(CCNC1)S(=O)(=O)C MCULE-2262553974 [0,1,0,0,1,0|1,0,1]=4 3924 B9R1.19 C1(CCNC1)S(=O)(=O)C MCULE-7002693105 [0,1,0,0,1,0|1,0,1]=4 3925 B9R1.19 CC(C)(O)C1CCCC1 MCULE-5080602177 [0,1,0,0,1,0|1,0,1]=4 3926 B9R1.19 CC(C)(O)C1CCCN1 MCULE-3058549783 [0,1,0,0,1,0|1,0,1]=4 3927 B9R1.19 CC(C)(O)C1CCCN1 MCULE-7282873348 [0,1,0,0,1,0|1,0,1]=4 3928 B9R1.19 CC(C)(O)C1CCNC1 MCULE-6641993906 [0,1,0,0,1,0|1,0,1]=4 3929 B9R1.19 CC(C)(O)C1CCNC1 MCULE-7962965541 [0,1,0,0,1,0|1,0,1]=4 3930 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-2324069180 [0,1,0,0,1,0|1,0,1]=4 3931 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3595619735 [0,1,0,0,1,0|1,0,1]=4 3932 B9R1.19 CC(C)(O)[C@@H]1CCCN1 MCULE-3842553890 [0,1,0,0,1,0|1,0,1]=4 3933 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-2734899119 [0,1,0,0,1,0|1,0,1]=4 3934 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-4295897789 [0,1,0,0,1,0|1,0,1]=4 3935 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-7600351767 [0,1,0,0,1,0|1,0,1]=4 3936 B9R1.19 CC(C)(O)[C@@H]1CCNC1 MCULE-9314777744 [0,1,0,0,1,0|1,0,1]=4 3937 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-1082062321 [0,1,0,0,1,0|1,0,1]=4 3938 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-5364741590 [0,1,0,0,1,0|1,0,1]=4 3939 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-8737105400 [0,1,0,0,1,0|1,0,1]=4 3940 B9R1.19 CC(C)(O)[C@H]1CCCN1 MCULE-9021200021 [0,1,0,0,1,0|1,0,1]=4 3941 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-3360210192 [0,1,0,0,1,0|1,0,1]=4 3942 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-6542450494 [0,1,0,0,1,0|1,0,1]=4 3943 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-6716834842 [0,1,0,0,1,0|1,0,1]=4 3944 B9R1.19 CC(C)(O)[C@H]1CCNC1 MCULE-9327175954 [0,1,0,0,1,0|1,0,1]=4 3945 B9R1.19 CS(=N)(=O)C1CCCC1 MCULE-8190422965 [0,1,0,0,1,0|2,0,0]=4 3946 B9R1.19 CS(=O)(=O)C1CCNC1 MCULE-1178327423 [0,1,0,0,1,0|1,0,1]=4 3947 B9R1.19 CS(=O)(=O)C1CCNC1 MCULE-6031307208 [0,1,0,0,1,0|1,0,1]=4 3948 B9R1.19 CS(=O)(=O)[C@@H]1CCNC1 MCULE-2122039252 [0,1,0,0,1,0|1,0,1]=4 3949 B9R1.19 CS(=O)(=O)[C@@H]1CCNC1 MCULE-2808858501 [0,1,0,0,1,0|1,0,1]=4 3950 B9R1.19 CS(=O)(=O)[C@@H]1CCNC1 MCULE-8565684503 [0,1,0,0,1,0|1,0,1]=4 3951 B9R1.19 CS(=O)(=O)[C@@H]1CCNC1 MCULE-9368369042 [0,1,0,0,1,0|1,0,1]=4 3952 B9R1.19 CS(=O)(=O)[C@H]1CCNC1 MCULE-1249395098 [0,1,0,0,1,0|1,0,1]=4 3953 B9R1.19 CS(=O)(=O)[C@H]1CCNC1 MCULE-1676947741 [0,1,0,0,1,0|1,0,1]=4 3954 B9R1.19 CS(=O)(=O)[C@H]1CCNC1 MCULE-1897478396 [0,1,0,0,1,0|1,0,1]=4 3955 B9R1.19 CS(=O)(=O)[C@H]1CCNC1 MCULE-6321703108 [0,1,0,0,1,0|1,0,1]=4 3956 B9R1.19 NS(=O)(=O)C1CCCC1 MCULE-9765667947 [0,1,0,0,1,0|1,0,1]=4 3957 B9R1.19 NS(=O)(=O)C1CCNC1 MCULE-3833904683 [0,1,0,0,1,0|1,0,1]=4 3958 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-1507527616 [0,1,0,0,1,0|1,0,0]=3 3959 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-9994872613 [0,1,0,0,1,0|1,0,0]=3 3960 B9R1.19 O=S(=O)(Cl)C1CCCC1 MCULE-7841465275 [0,1,0,0,1,0|1,0,1]=4 3961 B9R1.19 O=S(=O)(F)C1CCNC1 MCULE-2387457228 [0,1,0,0,1,0|1,0,1]=4 3962 B9R1.19 O=S(=O)(F)C1CCNC1 MCULE-2452179648 [0,1,0,0,1,0|1,0,1]=4 3963 B9R1.19 O=S(=O)(O)C1CCCC1 MCULE-7644931575 [0,1,0,0,1,0|1,0,0]=3 3964 B9R1.19 O=S(=O)([O-])C1CCCC1 MCULE-4567108567 [0,1,0,0,1,0|1,0,1]=4 3965 B9R1.35 C1(CCC(=O)C1)C(=O)O MCULE-7485965564 [0,1,0,0,1,0|0,0,1]=3 3966 B9R1.35 C1(CCC(=O)O1)C(=O)O MCULE-6663255579 [0,1,0,0,1,0|1,0,1]=4 3967 B9R1.35 C1(CCN(C1)C(=O)C)O MCULE-2995435877 [0,1,0,0,1,0|2,0,0]=4 3968 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-6561840637 [0,1,0,0,1,0|0,0,0]=2 3969 B9R1.35 C1(CCN(C1)C)C(=O)O MCULE-7766846765 [0,1,0,0,1,0|0,0,0]=2 3970 B9R1.35 C=C1CCC(C1)C(=O)O MCULE-7982355069 [0,1,0,0,1,0|0,0,1]=3 3971 B9R1.35 CC(=O)C1CCN(C1)C MCULE-4293303594 [0,1,0,0,1,0|1,0,0]=3 3972 B9R1.35 CC(=O)N1CCC(C1)Br MCULE-8355936501 [0,1,0,0,1,0|2,0,0]=4 3973 B9R1.35 CC(=O)N1CCC(C1)Cl MCULE-6832350132 [0,1,0,0,1,0|2,0,0]=4 3974 B9R1.35 CC(=O)N1CCC(C1)I MCULE-8317311112 [0,1,0,0,1,0|2,0,0]=4 3975 B9R1.35 CC(=O)N1CCC(C1)N MCULE-4859899694 [0,1,0,0,1,0|2,0,0]=4 3976 B9R1.35 CC(=O)N1CCC(C1)N MCULE-5207016672 [0,1,0,0,1,0|2,0,0]=4 3977 B9R1.35 CC(=O)N1CCC(C1)O MCULE-4508537142 [0,1,0,0,1,0|2,0,0]=4 3978 B9R1.35 CC(=O)N1CC[C@@H](C1)Br MCULE-1322966275 [0,1,0,0,1,0|2,0,0]=4 3979 B9R1.35 CC(=O)N1CC[C@@H](C1)Cl MCULE-2029967624 [0,1,0,0,1,0|2,0,0]=4 3980 B9R1.35 CC(=O)N1CC[C@@H](C1)I MCULE-7320383470 [0,1,0,0,1,0|2,0,0]=4 3981 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-2398948421 [0,1,0,0,1,0|2,0,0]=4 3982 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-5902852942 [0,1,0,0,1,0|2,0,0]=4 3983 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-7792031754 [0,1,0,0,1,0|2,0,0]=4 3984 B9R1.35 CC(=O)N1CC[C@@H](C1)N MCULE-9501815600 [0,1,0,0,1,0|2,0,0]=4 3985 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-4145127323 [0,1,0,0,1,0|2,0,0]=4 3986 B9R1.35 CC(=O)N1CC[C@@H](C1)O MCULE-8205833952 [0,1,0,0,1,0|2,0,0]=4 3987 B9R1.35 CC(=O)N1CC[C@H](C1)Br MCULE-4315476515 [0,1,0,0,1,0|2,0,0]=4 3988 B9R1.35 CC(=O)N1CC[C@H](C1)Cl MCULE-4172580306 [0,1,0,0,1,0|2,0,0]=4 3989 B9R1.35 CC(=O)N1CC[C@H](C1)I MCULE-1825691667 [0,1,0,0,1,0|2,0,0]=4 3990 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-2775875761 [0,1,0,0,1,0|2,0,0]=4 3991 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-3800389790 [0,1,0,0,1,0|2,0,0]=4 3992 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-5934390450 [0,1,0,0,1,0|2,0,0]=4 3993 B9R1.35 CC(=O)N1CC[C@H](C1)N MCULE-6629805054 [0,1,0,0,1,0|2,0,0]=4 3994 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1031340554 [0,1,0,0,1,0|2,0,0]=4 3995 B9R1.35 CC(=O)N1CC[C@H](C1)O MCULE-1348897751 [0,1,0,0,1,0|2,0,0]=4 3996 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-1278773172 [0,1,0,0,1,0|0,0,2]=4 3997 B9R1.35 CC1=NC(CC1)C(=O)O MCULE-5768248357 [0,1,0,0,1,0|0,0,2]=4 3998 B9R1.35 CC1CC(CO1)C(=O)O MCULE-6422706201 [0,1,0,0,1,0|1,0,0]=3 3999 B9R1.35 CC1CCC(C1)C(=O)O MCULE-5009837194 [0,1,0,0,1,0|0,0,0]=2 4000 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7716142893 [0,1,0,0,1,0|0,0,0]=2 4001 B9R1.35 CC1CCC(N1)C(=O)O MCULE-7805688291 [0,1,0,0,1,0|0,0,0]=2 4002 B9R1.35 CC1CCC(O1)C(=O)O MCULE-7354058760 [0,1,0,0,1,0|1,0,0]=3 4003 B9R1.35 CC1CCN(C1)C(=O)Cl MCULE-4918001156 [0,1,0,0,1,0|2,0,0]=4 4004 B9R1.35 CC1CNC(C1)C(=O)O MCULE-5999128275 [0,1,0,0,1,0|0,0,0]=2 4005 B9R1.35 CC1CNC(C1)C(=O)O MCULE-9035040660 [0,1,0,0,1,0|0,0,0]=2 4006 B9R1.35 CC1COC(C1)C(=O)O MCULE-4317519603 [0,1,0,0,1,0|1,0,0]=3 4007 B9R1.35 CC1NC(CS1)C(=O)O MCULE-3100233154 [0,1,0,0,1,0|1,0,0]=3 4008 B9R1.35 CC1N[C@H](CS1)C(=O)O MCULE-6392464999 [0,1,0,0,1,0|1,0,0]=3 4009 B9R1.35 CN1C=NC(C1)C(=O)O MCULE-4940976118 [0,1,0,0,1,0|1,0,1]=4 4010 B9R1.35 CN1C=NC(C1)C(=O)O MCULE-8264815969 [0,1,0,0,1,0|1,0,1]=4 4011 B9R1.35 CN1CCC(C1)C(=O)O MCULE-5724245212 [0,1,0,0,1,0|0,0,0]=2 4012 B9R1.35 CN1CCC(C1)C(=O)O MCULE-6263233064 [0,1,0,0,1,0|0,0,0]=2 4013 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1382244459 [0,1,0,0,1,0|0,0,0]=2 4014 B9R1.35 CN1CC[C@@H](C1)C(=O)O MCULE-1492032594 [0,1,0,0,1,0|0,0,0]=2 4015 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-1080921095 [0,1,0,0,1,0|0,0,0]=2 4016 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5145674459 [0,1,0,0,1,0|0,0,0]=2 4017 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-5820812779 [0,1,0,0,1,0|0,0,0]=2 4018 B9R1.35 CN1CC[C@H](C1)C(=O)O MCULE-7587726735 [0,1,0,0,1,0|0,0,0]=2 4019 B9R1.35 CS(=O)C1CCC(C1)N MCULE-2472662986 [0,1,0,0,1,0|2,0,0]=4 4020 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-1712610304 [0,1,0,0,1,0|0,0,0]=2 4021 B9R1.35 C[C@@H]1CC[C@@H](N1)C(=O)O MCULE-3564743814 [0,1,0,0,1,0|0,0,0]=2 4022 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-2451266259 [0,1,0,0,1,0|1,0,0]=3 4023 B9R1.35 C[C@@H]1CC[C@@H](O1)C(=O)O MCULE-9559412763 [0,1,0,0,1,0|1,0,0]=3 4024 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-1486502980 [0,1,0,0,1,0|0,0,0]=2 4025 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-2728269167 [0,1,0,0,1,0|0,0,0]=2 4026 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-4518040079 [0,1,0,0,1,0|0,0,0]=2 4027 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5687588737 [0,1,0,0,1,0|0,0,0]=2 4028 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-5969663507 [0,1,0,0,1,0|0,0,0]=2 4029 B9R1.35 C[C@@H]1CC[C@H](N1)C(=O)O MCULE-7325534692 [0,1,0,0,1,0|0,0,0]=2 4030 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1541572989 [0,1,0,0,1,0|0,0,0]=2 4031 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-1821254522 [0,1,0,0,1,0|0,0,0]=2 4032 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7426280517 [0,1,0,0,1,0|0,0,0]=2 4033 B9R1.35 C[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8599307960 [0,1,0,0,1,0|0,0,0]=2 4034 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3116688346 [0,1,0,0,1,0|0,0,0]=2 4035 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-3630959366 [0,1,0,0,1,0|0,0,0]=2 4036 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9043504063 [0,1,0,0,1,0|0,0,0]=2 4037 B9R1.35 C[C@H]1CC[C@@H](N1)C(=O)O MCULE-9322368857 [0,1,0,0,1,0|0,0,0]=2 4038 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-2036600768 [0,1,0,0,1,0|0,0,0]=2 4039 B9R1.35 C[C@H]1CN[C@@H](C1)C(=O)O MCULE-4646350445 [0,1,0,0,1,0|0,0,0]=2 4040 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-2974063836 [0,1,0,0,1,0|0,0,0]=2 4041 B9R1.35 C[C@H]1CN[C@H](C1)C(=O)O MCULE-7564386283 [0,1,0,0,1,0|0,0,0]=2 4042 B9R1.35 NC(=O)C1CC(CN1)F MCULE-8271084148 [0,1,0,0,1,0|1,0,0]=3 4043 B9R1.35 NC(=O)C1CC(CN1)F MCULE-9864087367 [0,1,0,0,1,0|1,0,0]=3 4044 B9R1.35 NC(=O)C1CC(CN1)O MCULE-8628888959 [0,1,0,0,1,0|1,0,0]=3 4045 B9R1.35 NC(=O)C1CC(CN1)O MCULE-9327040437 [0,1,0,0,1,0|1,0,0]=3 4046 B9R1.35 NC(=O)C1CCC(=O)N1 MCULE-1717146839 [0,1,0,0,1,0|1,0,1]=4 4047 B9R1.35 NC(=O)C1CNC(=O)C1 MCULE-2954653092 [0,1,0,0,1,0|1,0,1]=4 4048 B9R1.35 NC(=O)N1CCC(C1)N MCULE-1767398338 [0,1,0,0,1,0|2,0,0]=4 4049 B9R1.35 NC(=O)N1CCC(C1)N MCULE-2883297977 [0,1,0,0,1,0|2,0,0]=4 4050 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 MCULE-5928054942 [0,1,0,0,1,0|1,0,1]=4 4051 B9R1.35 NC(=O)[C@@H]1CCC(=O)N1 MCULE-8978218986 [0,1,0,0,1,0|1,0,1]=4 4052 B9R1.35 NC(=O)[C@@H]1CC[C@@H](C1)N MCULE-7570889128 [0,1,0,0,1,0|1,0,0]=3 4053 B9R1.35 NC(=O)[C@@H]1CC[C@@H](C1)N MCULE-8629602486 [0,1,0,0,1,0|1,0,0]=3 4054 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-1115995515 [0,1,0,0,1,0|1,0,0]=3 4055 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-3958905536 [0,1,0,0,1,0|1,0,0]=3 4056 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-5421731805 [0,1,0,0,1,0|1,0,0]=3 4057 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F MCULE-9864372515 [0,1,0,0,1,0|1,0,0]=3 4058 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-1506534259 [0,1,0,0,1,0|1,0,0]=3 4059 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)O MCULE-4335155413 [0,1,0,0,1,0|1,0,0]=3 4060 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-2111867079 [0,1,0,0,1,0|1,0,0]=3 4061 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-2486268743 [0,1,0,0,1,0|1,0,0]=3 4062 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)F MCULE-8625619596 [0,1,0,0,1,0|1,0,0]=3 4063 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-1442980635 [0,1,0,0,1,0|1,0,0]=3 4064 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-4854132547 [0,1,0,0,1,0|1,0,0]=3 4065 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-8175631848 [0,1,0,0,1,0|1,0,0]=3 4066 B9R1.35 NC(=O)[C@@H]1C[C@H](CN1)O MCULE-9092665787 [0,1,0,0,1,0|1,0,0]=3 4067 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-1212665796 [0,1,0,0,1,0|1,0,0]=3 4068 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2172080185 [0,1,0,0,1,0|1,0,0]=3 4069 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-2463066874 [0,1,0,0,1,0|1,0,0]=3 4070 B9R1.35 NC(=O)[C@H]1C[C@H](CN1)O MCULE-7245012102 [0,1,0,0,1,0|1,0,0]=3 4071 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-7513224290 [0,1,0,0,1,0|0,0,2]=4 4072 B9R1.35 NC1C=CC(C1)C(=O)O MCULE-8369262706 [0,1,0,0,1,0|0,0,2]=4 4073 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-7944190057 [0,1,0,0,1,0|0,0,2]=4 4074 B9R1.35 NC1CC=C(C1)C(=O)O MCULE-9202589777 [0,1,0,0,1,0|0,0,2]=4 4075 B9R1.35 NC1CCC(C1)C(=O)O MCULE-1740452568 [0,1,0,0,1,0|0,0,0]=2 4076 B9R1.35 NC1CCC(C1)C(=O)O MCULE-4067702279 [0,1,0,0,1,0|0,0,0]=2 4077 B9R1.35 NC1CNC(C1)C(=O)O MCULE-1416144501 [0,1,0,0,1,0|0,0,0]=2 4078 B9R1.35 NC1CNC(C1)C(=O)O MCULE-4706388278 [0,1,0,0,1,0|0,0,0]=2 4079 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-2058033578 [0,1,0,0,1,0|0,0,2]=4 4080 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-3535904120 [0,1,0,0,1,0|0,0,2]=4 4081 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-7864688668 [0,1,0,0,1,0|0,0,2]=4 4082 B9R1.35 N[C@@H]1C=C[C@@H](C1)C(=O)O MCULE-9488093105 [0,1,0,0,1,0|0,0,2]=4 4083 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-1729778339 [0,1,0,0,1,0|0,0,0]=2 4084 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-2964730214 [0,1,0,0,1,0|0,0,0]=2 4085 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-6758665117 [0,1,0,0,1,0|0,0,0]=2 4086 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O MCULE-8002401712 [0,1,0,0,1,0|0,0,0]=2 4087 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-1941635524 [0,1,0,0,1,0|0,0,0]=2 4088 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-3306995596 [0,1,0,0,1,0|0,0,0]=2 4089 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-5728201062 [0,1,0,0,1,0|0,0,0]=2 4090 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O MCULE-8515718052 [0,1,0,0,1,0|0,0,0]=2 4091 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-4990800122 [0,1,0,0,1,0|0,0,0]=2 4092 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5172267597 [0,1,0,0,1,0|0,0,0]=2 4093 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-7010431429 [0,1,0,0,1,0|0,0,0]=2 4094 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O MCULE-8754522437 [0,1,0,0,1,0|0,0,0]=2 4095 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-4906071490 [0,1,0,0,1,0|0,0,0]=2 4096 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-7656739611 [0,1,0,0,1,0|0,0,0]=2 4097 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-8732136397 [0,1,0,0,1,0|0,0,0]=2 4098 B9R1.35 N[C@@H]1CN[C@H](C1)C(=O)O MCULE-9871023526 [0,1,0,0,1,0|0,0,0]=2 4099 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-1866924065 [0,1,0,0,1,0|0,0,2]=4 4100 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-5420586850 [0,1,0,0,1,0|0,0,2]=4 4101 B9R1.35 N[C@H]1C=C[C@@H](C1)C(=O)O MCULE-6933168017 [0,1,0,0,1,0|0,0,2]=4 4102 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-1923367161 [0,1,0,0,1,0|0,0,2]=4 4103 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2558762790 [0,1,0,0,1,0|0,0,2]=4 4104 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-2767032719 [0,1,0,0,1,0|0,0,2]=4 4105 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-3230012761 [0,1,0,0,1,0|0,0,2]=4 4106 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-5898455500 [0,1,0,0,1,0|0,0,2]=4 4107 B9R1.35 N[C@H]1C=C[C@H](C1)C(=O)O MCULE-8841082803 [0,1,0,0,1,0|0,0,2]=4 4108 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-3382663689 [0,1,0,0,1,0|0,0,0]=2 4109 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-7889100863 [0,1,0,0,1,0|0,0,0]=2 4110 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9213747671 [0,1,0,0,1,0|0,0,0]=2 4111 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O MCULE-9781594017 [0,1,0,0,1,0|0,0,0]=2 4112 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1569946940 [0,1,0,0,1,0|0,0,0]=2 4113 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1675680486 [0,1,0,0,1,0|0,0,0]=2 4114 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-1903292573 [0,1,0,0,1,0|0,0,0]=2 4115 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6695566760 [0,1,0,0,1,0|0,0,0]=2 4116 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-6999679319 [0,1,0,0,1,0|0,0,0]=2 4117 B9R1.35 N[C@H]1CC[C@H](C1)C(=O)O MCULE-8009804408 [0,1,0,0,1,0|0,0,0]=2 4118 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1698400731 [0,1,0,0,1,0|0,0,0]=2 4119 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-1983861108 [0,1,0,0,1,0|0,0,0]=2 4120 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-2838978471 [0,1,0,0,1,0|0,0,0]=2 4121 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5103662767 [0,1,0,0,1,0|0,0,0]=2 4122 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-5299594489 [0,1,0,0,1,0|0,0,0]=2 4123 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-6235136925 [0,1,0,0,1,0|0,0,0]=2 4124 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O MCULE-8629641721 [0,1,0,0,1,0|0,0,0]=2 4125 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-2973551231 [0,1,0,0,1,0|0,0,0]=2 4126 B9R1.35 N[C@H]1CN[C@H](C1)C(=O)O MCULE-3190600485 [0,1,0,0,1,0|0,0,0]=2 4127 B9R1.35 O=C(O)C1=CC(CC1)O MCULE-6046983646 [0,1,0,0,1,0|0,0,2]=4 4128 B9R1.35 O=C(O)C1CC(CN1)Br MCULE-3420644560 [0,1,0,0,1,0|0,0,0]=2 4129 B9R1.35 O=C(O)C1CC(CN1)F MCULE-1909829604 [0,1,0,0,1,0|0,0,0]=2 4130 B9R1.35 O=C(O)C1CC(CN1)F MCULE-4908563055 [0,1,0,0,1,0|0,0,0]=2 4131 B9R1.35 O=C(O)C1CC(CN1)O MCULE-3129945874 [0,1,0,0,1,0|0,0,0]=2 4132 B9R1.35 O=C(O)C1CC(CN1)O MCULE-5090896550 [0,1,0,0,1,0|0,0,0]=2 4133 B9R1.35 O=C(O)C1CC(CN1)S MCULE-3928449068 [0,1,0,0,1,0|0,0,0]=2 4134 B9R1.35 O=C(O)C1CC(CN1)S MCULE-7523385510 [0,1,0,0,1,0|0,0,0]=2 4135 B9R1.35 O=C(O)C1CCC(C1)Br MCULE-3893521468 [0,1,0,0,1,0|0,0,0]=2 4136 B9R1.35 O=C(O)C1CCC(C1)F MCULE-5981771251 [0,1,0,0,1,0|0,0,0]=2 4137 B9R1.35 O=C(O)C1CCC(C1)O MCULE-3301759971 [0,1,0,0,1,0|0,0,0]=2 4138 B9R1.35 O=C(O)C1CSC(=S)N1 MCULE-1769481962 [0,1,0,0,1,0|1,0,1]=4 4139 B9R1.35 O=C(O)C1OC(CS1)O MCULE-2827262093 [0,1,0,0,1,0|2,0,0]=4 4140 B9R1.35 O=C(O)[C@@H]1CC(CN1)O MCULE-9602889253 [0,1,0,0,1,0|0,0,0]=2 4141 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6078892837 [0,1,0,0,1,0|0,0,0]=2 4142 B9R1.35 O=C(O)[C@@H]1CC(CN1)S MCULE-6607761456 [0,1,0,0,1,0|0,0,0]=2 4143 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-2017780821 [0,1,0,0,1,0|0,0,0]=2 4144 B9R1.35 O=C(O)[C@@H]1CC[C@@H](C1)O MCULE-8789755356 [0,1,0,0,1,0|0,0,0]=2 4145 B9R1.35 O=C(O)[C@@H]1CC[C@H](C1)O MCULE-6133795580 [0,1,0,0,1,0|0,0,0]=2 4146 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 MCULE-3331947152 [0,1,0,0,1,0|1,0,1]=4 4147 B9R1.35 O=C(O)[C@@H]1CSC(=S)N1 MCULE-7575485678 [0,1,0,0,1,0|1,0,1]=4 4148 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-2600938020 [0,1,0,0,1,0|0,0,0]=2 4149 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)Br MCULE-3945615781 [0,1,0,0,1,0|0,0,0]=2 4150 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-2626475344 [0,1,0,0,1,0|0,0,0]=2 4151 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-4367319835 [0,1,0,0,1,0|0,0,0]=2 4152 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9011373659 [0,1,0,0,1,0|0,0,0]=2 4153 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)F MCULE-9484602400 [0,1,0,0,1,0|0,0,0]=2 4154 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-2778155463 [0,1,0,0,1,0|0,0,0]=2 4155 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3005368457 [0,1,0,0,1,0|0,0,0]=2 4156 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3510440810 [0,1,0,0,1,0|0,0,0]=2 4157 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-6982589556 [0,1,0,0,1,0|0,0,0]=2 4158 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-8797295826 [0,1,0,0,1,0|0,0,0]=2 4159 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-5195240463 [0,1,0,0,1,0|0,0,0]=2 4160 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6442187313 [0,1,0,0,1,0|0,0,0]=2 4161 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-6472004515 [0,1,0,0,1,0|0,0,0]=2 4162 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)S MCULE-8668690351 [0,1,0,0,1,0|0,0,0]=2 4163 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-2784186920 [0,1,0,0,1,0|0,0,0]=2 4164 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-5745425542 [0,1,0,0,1,0|0,0,0]=2 4165 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9253930917 [0,1,0,0,1,0|0,0,0]=2 4166 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)F MCULE-9892414269 [0,1,0,0,1,0|0,0,0]=2 4167 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-4157512603 [0,1,0,0,1,0|0,0,0]=2 4168 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-5389747201 [0,1,0,0,1,0|0,0,0]=2 4169 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-6465399562 [0,1,0,0,1,0|0,0,0]=2 4170 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-7830616263 [0,1,0,0,1,0|0,0,0]=2 4171 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-1140594774 [0,1,0,0,1,0|0,0,0]=2 4172 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2383846785 [0,1,0,0,1,0|0,0,0]=2 4173 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-2747224270 [0,1,0,0,1,0|0,0,0]=2 4174 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-5598470577 [0,1,0,0,1,0|0,0,0]=2 4175 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-7268471922 [0,1,0,0,1,0|0,0,0]=2 4176 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)S MCULE-9896850390 [0,1,0,0,1,0|0,0,0]=2 4177 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-3061487094 [0,1,0,0,1,0|0,0,0]=2 4178 B9R1.35 O=C(O)[C@H]1CC[C@@H](C1)O MCULE-8079944181 [0,1,0,0,1,0|0,0,0]=2 4179 B9R1.35 O=C(O)[C@H]1CC[C@H](C1)O MCULE-2713143734 [0,1,0,0,1,0|0,0,0]=2 4180 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-1499004749 [0,1,0,0,1,0|0,0,0]=2 4181 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-4961028667 [0,1,0,0,1,0|0,0,0]=2 4182 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)F MCULE-9323854334 [0,1,0,0,1,0|0,0,0]=2 4183 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1222229718 [0,1,0,0,1,0|0,0,0]=2 4184 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1998693022 [0,1,0,0,1,0|0,0,0]=2 4185 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-3836053642 [0,1,0,0,1,0|0,0,0]=2 4186 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-4545441904 [0,1,0,0,1,0|0,0,0]=2 4187 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-8358409700 [0,1,0,0,1,0|0,0,0]=2 4188 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-1326882154 [0,1,0,0,1,0|0,0,0]=2 4189 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-4409765623 [0,1,0,0,1,0|0,0,0]=2 4190 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-5169579313 [0,1,0,0,1,0|0,0,0]=2 4191 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)F MCULE-8834390438 [0,1,0,0,1,0|0,0,0]=2 4192 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-3080568728 [0,1,0,0,1,0|0,0,0]=2 4193 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-4521316626 [0,1,0,0,1,0|0,0,0]=2 4194 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-5972935636 [0,1,0,0,1,0|0,0,0]=2 4195 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-7908625938 [0,1,0,0,1,0|0,0,0]=2 4196 B9R1.35 O=C1CC(CN1)C(=O)O MCULE-2190630193 [0,1,0,0,1,0|0,0,1]=3 4197 B9R1.35 O=C1CC(CO1)C(=O)O MCULE-4876585769 [0,1,0,0,1,0|1,0,1]=4 4198 B9R1.35 O=C1CC(CS1)C(=O)O MCULE-5763665475 [0,1,0,0,1,0|1,0,1]=4 4199 B9R1.35 O=C1CC(NN1)C(=O)O MCULE-3197471189 [0,1,0,0,1,0|1,0,1]=4 4200 B9R1.35 O=C1CCC(C1)C(=O)O MCULE-8715651663 [0,1,0,0,1,0|0,0,1]=3 4201 B9R1.35 O=C1CCC(N1)C(=O)Cl MCULE-7943877958 [0,1,0,0,1,0|1,0,1]=4 4202 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-4175874303 [0,1,0,0,1,0|0,0,1]=3 4203 B9R1.35 O=C1CCC(N1)C(=O)O MCULE-9028773140 [0,1,0,0,1,0|0,0,1]=3 4204 B9R1.35 O=C1CCC(N1)C(=O)[O-] MCULE-1554748470 [0,1,0,0,1,0|0,0,2]=4 4205 B9R1.35 O=C1CCC(O1)C(=O)O MCULE-1992756541 [0,1,0,0,1,0|1,0,1]=4 4206 B9R1.35 O=C1CCC(S1)C(=O)O MCULE-8929436839 [0,1,0,0,1,0|1,0,1]=4 4207 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-1554776363 [0,1,0,0,1,0|0,0,1]=3 4208 B9R1.35 O=C1CC[C@@H](C1)C(=O)O MCULE-4649943680 [0,1,0,0,1,0|0,0,1]=3 4209 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-5900221010 [0,1,0,0,1,0|0,0,1]=3 4210 B9R1.35 O=C1CC[C@@H](N1)C(=O)O MCULE-8170238114 [0,1,0,0,1,0|0,0,1]=3 4211 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-1446049605 [0,1,0,0,1,0|1,0,1]=4 4212 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-6745317325 [0,1,0,0,1,0|1,0,1]=4 4213 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-6597072682 [0,1,0,0,1,0|0,0,1]=3 4214 B9R1.35 O=C1CC[C@H](C1)C(=O)O MCULE-7880064966 [0,1,0,0,1,0|0,0,1]=3 4215 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4204877494 [0,1,0,0,1,0|0,0,1]=3 4216 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-4908547112 [0,1,0,0,1,0|0,0,1]=3 4217 B9R1.35 O=C1CC[C@H](N1)C(=O)O MCULE-6422141688 [0,1,0,0,1,0|0,0,1]=3 4218 B9R1.35 O=C1CC[C@H](N1)C(=O)[O-] MCULE-2892153827 [0,1,0,0,1,0|0,0,2]=4 4219 B9R1.35 O=C1CC[C@H](N1)C(=O)[O-] MCULE-8083669516 [0,1,0,0,1,0|0,0,2]=4 4220 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-5669975621 [0,1,0,0,1,0|1,0,1]=4 4221 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-7113736527 [0,1,0,0,1,0|1,0,1]=4 4222 B9R1.35 O=C1CC[C@H](S1)C(=O)O MCULE-4843749267 [0,1,0,0,1,0|1,0,1]=4 4223 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7418065190 [0,1,0,0,1,0|0,0,1]=3 4224 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7697956784 [0,1,0,0,1,0|0,0,1]=3 4225 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-9520720032 [0,1,0,0,1,0|0,0,1]=3 4226 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-2573903934 [0,1,0,0,1,0|0,0,1]=3 4227 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-3585746586 [0,1,0,0,1,0|0,0,1]=3 4228 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4771747932 [0,1,0,0,1,0|0,0,1]=3 4229 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4795592072 [0,1,0,0,1,0|0,0,1]=3 4230 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-6928857625 [0,1,0,0,1,0|0,0,1]=3 4231 B9R1.35 O=C1COC(C1)C(=O)O MCULE-4720798204 [0,1,0,0,1,0|1,0,1]=4 4232 B9R1.35 O=C1CSC(C1)C(=O)O MCULE-3309649635 [0,1,0,0,1,0|1,0,1]=4 4233 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-5673992530 [0,1,0,0,1,0|0,0,1]=3 4234 B9R1.35 O=C1C[C@@H](CN1)C(=O)O MCULE-8443757903 [0,1,0,0,1,0|0,0,1]=3 4235 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-1024601569 [0,1,0,0,1,0|0,0,1]=3 4236 B9R1.35 O=C1C[C@H](CN1)C(=O)O MCULE-4280238532 [0,1,0,0,1,0|0,0,1]=3 4237 B9R1.35 O=C1NC(CO1)C(=O)O MCULE-5946769187 [0,1,0,0,1,0|1,0,1]=4 4238 B9R1.35 O=C1NC(CS1)C(=O)O MCULE-4574359237 [0,1,0,0,1,0|1,0,1]=4 4239 B9R1.35 O=C1NCC(N1)C(=O)O MCULE-5872947769 [0,1,0,0,1,0|1,0,1]=4 4240 B9R1.35 O=C1NCC(O1)C(=O)O MCULE-2773613806 [0,1,0,0,1,0|1,0,1]=4 4241 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-3499982275 [0,1,0,0,1,0|1,0,1]=4 4242 B9R1.35 O=C1NC[C@@H](N1)C(=O)O MCULE-9995046216 [0,1,0,0,1,0|1,0,1]=4 4243 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-2524102915 [0,1,0,0,1,0|1,0,1]=4 4244 B9R1.35 O=C1NC[C@H](N1)C(=O)O MCULE-5992511798 [0,1,0,0,1,0|1,0,1]=4 4245 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-5972751457 [0,1,0,0,1,0|1,0,1]=4 4246 B9R1.35 O=C1NC[C@H](O1)C(=O)O MCULE-6879191654 [0,1,0,0,1,0|1,0,1]=4 4247 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-2786614278 [0,1,0,0,1,0|1,0,1]=4 4248 B9R1.35 O=C1N[C@@H](CO1)C(=O)O MCULE-8589745511 [0,1,0,0,1,0|1,0,1]=4 4249 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-8232416107 [0,1,0,0,1,0|1,0,1]=4 4250 B9R1.35 O=C1N[C@@H](CS1)C(=O)O MCULE-9439896780 [0,1,0,0,1,0|1,0,1]=4 4251 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-3716829138 [0,1,0,0,1,0|1,0,1]=4 4252 B9R1.35 O=C1N[C@H](CO1)C(=O)O MCULE-9300998688 [0,1,0,0,1,0|1,0,1]=4 4253 B9R1.35 O=C1N[C@H](CS1)C(=O)O MCULE-3120744944 [0,1,0,0,1,0|1,0,1]=4 4254 B9R1.35 [C@@H]1(CN[C@H](C1)C(=O)O)O MCULE-3075663401 [0,1,0,0,1,0|0,0,0]=2 4255 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-1734860042 [0,1,0,0,1,0|0,0,0]=2 4256 B9R1.35 [C@H]1(CC[C@H](C1)C(=O)O)N MCULE-3698574567 [0,1,0,0,1,0|0,0,0]=2 4257 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)N)F MCULE-2355223336 [0,1,0,0,1,0|1,0,0]=3 4258 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)N)F MCULE-2483830451 [0,1,0,0,1,0|1,0,0]=3 4259 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-1784559931 [0,1,0,0,1,0|0,0,0]=2 4260 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)F MCULE-8392302309 [0,1,0,0,1,0|0,0,0]=2 4261 B9R1.35 [C@H]1(CN[C@@H](C1)C(=O)O)S MCULE-7662717521 [0,1,0,0,1,0|0,0,0]=2 4262 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-2026019561 [0,1,0,0,1,0|0,0,0]=2 4263 B9R1.35 [C@H]1(CN[C@H](C1)C(=O)O)F MCULE-8023038198 [0,1,0,0,1,0|0,0,0]=2 4264 B9R1.35 [C@H]1(C[C@H](CN1)O)C(=O)O MCULE-3462627258 [0,1,0,0,1,0|0,0,0]=2 4265 B9R1.41 C1(CCCN1C)C(=O)O MCULE-7988130618 [0,1,0,0,1,0|0,0,0]=2 4266 B9R1.41 CC(=O)C1CCCC1=O MCULE-8152440536 [0,1,0,0,1,0|1,0,1]=4 4267 B9R1.41 CC(O)C1CCCN1C MCULE-1709841217 [0,1,0,0,1,0|1,0,1]=4 4268 B9R1.41 CC1=C(CCC1)C(=O)O MCULE-4166872703 [0,1,0,0,1,0|0,0,2]=4 4269 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [0,1,0,0,1,0|0,0,0]=2 4270 B9R1.41 CC1CCNC1C(=O)O MCULE-3835684911 [0,1,0,0,1,0|0,0,0]=2 4271 B9R1.41 CC1CCNC1C(=O)O MCULE-8361777649 [0,1,0,0,1,0|0,0,0]=2 4272 B9R1.41 CC1CNCC1C(=O)O MCULE-1581522558 [0,1,0,0,1,0|0,0,0]=2 4273 B9R1.41 CC1CNCC1C(=O)O MCULE-6848551085 [0,1,0,0,1,0|0,0,0]=2 4274 B9R1.41 CC1NCCC1C(=O)O MCULE-5042669811 [0,1,0,0,1,0|0,0,0]=2 4275 B9R1.41 CC1NCCC1C(=O)O MCULE-8546677468 [0,1,0,0,1,0|0,0,0]=2 4276 B9R1.41 CC1OCCC1C(=O)O MCULE-4181521736 [0,1,0,0,1,0|1,0,0]=3 4277 B9R1.41 CN1CC=CC1C(=O)O MCULE-5525753116 [0,1,0,0,1,0|0,0,2]=4 4278 B9R1.41 CN1CC=CC1C(=O)O MCULE-8585806688 [0,1,0,0,1,0|0,0,2]=4 4279 B9R1.41 CN1CCCC1C(=O)N MCULE-1474656837 [0,1,0,0,1,0|1,0,0]=3 4280 B9R1.41 CN1CCCC1C(=O)O MCULE-4884381644 [0,1,0,0,1,0|0,0,0]=2 4281 B9R1.41 CN1CCCC1C(=O)O MCULE-6241162207 [0,1,0,0,1,0|0,0,0]=2 4282 B9R1.41 CN1CCCC1C(=O)O MCULE-7232060205 [0,1,0,0,1,0|0,0,0]=2 4283 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1129223179 [0,1,0,0,1,0|1,0,0]=3 4284 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1418743058 [0,1,0,0,1,0|1,0,0]=3 4285 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-3947573313 [0,1,0,0,1,0|0,0,0]=2 4286 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-4168419254 [0,1,0,0,1,0|0,0,0]=2 4287 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-6504349835 [0,1,0,0,1,0|0,0,0]=2 4288 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-9943329201 [0,1,0,0,1,0|0,0,0]=2 4289 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-1155656545 [0,1,0,0,1,0|1,0,0]=3 4290 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-5987152150 [0,1,0,0,1,0|1,0,0]=3 4291 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-1661156416 [0,1,0,0,1,0|0,0,0]=2 4292 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-2535799805 [0,1,0,0,1,0|0,0,0]=2 4293 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-3283459585 [0,1,0,0,1,0|0,0,0]=2 4294 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-5506159927 [0,1,0,0,1,0|0,0,0]=2 4295 B9R1.41 CN1CSCC1C(=O)O MCULE-6053778396 [0,1,0,0,1,0|1,0,0]=3 4296 B9R1.41 CN1CSCC1C(=O)O MCULE-8768199445 [0,1,0,0,1,0|1,0,0]=3 4297 B9R1.41 CN1CSC[C@@H]1C(=O)O MCULE-9390031358 [0,1,0,0,1,0|1,0,0]=3 4298 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-2295281512 [0,1,0,0,1,0|1,0,0]=3 4299 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-3344236668 [0,1,0,0,1,0|1,0,0]=3 4300 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-6116857567 [0,1,0,0,1,0|1,0,0]=3 4301 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-7315008971 [0,1,0,0,1,0|1,0,0]=3 4302 B9R1.41 C[C@@H]1CCN[C@@H]1C(=O)O MCULE-6239309390 [0,1,0,0,1,0|0,0,0]=2 4303 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-1608471752 [0,1,0,0,1,0|0,0,0]=2 4304 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-2896759092 [0,1,0,0,1,0|0,0,0]=2 4305 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O MCULE-5338216485 [0,1,0,0,1,0|1,0,0]=3 4306 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-3425733853 [0,1,0,0,1,0|0,0,0]=2 4307 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-5424989009 [0,1,0,0,1,0|0,0,0]=2 4308 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O MCULE-1674735474 [0,1,0,0,1,0|0,0,0]=2 4309 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-8959062032 [0,1,0,0,1,0|0,0,0]=2 4310 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-9340754868 [0,1,0,0,1,0|0,0,0]=2 4311 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4624227681 [0,1,0,0,1,0|1,0,0]=3 4312 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4653588182 [0,1,0,0,1,0|1,0,0]=3 4313 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-3481136719 [0,1,0,0,1,0|1,0,1]=4 4314 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-8355283874 [0,1,0,0,1,0|1,0,1]=4 4315 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-1694933393 [0,1,0,0,1,0|0,0,0]=2 4316 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-9088637113 [0,1,0,0,1,0|0,0,0]=2 4317 B9R1.41 C[C@H]1CCN[C@H]1C(=O)O MCULE-1449988566 [0,1,0,0,1,0|0,0,0]=2 4318 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-3190006541 [0,1,0,0,1,0|0,0,0]=2 4319 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-7835079063 [0,1,0,0,1,0|0,0,0]=2 4320 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-1189864899 [0,1,0,0,1,0|0,0,0]=2 4321 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-8012665255 [0,1,0,0,1,0|0,0,0]=2 4322 B9R1.41 NC(=O)C1CCCC1=O MCULE-2399127943 [0,1,0,0,1,0|1,0,1]=4 4323 B9R1.41 NC(=O)C1CCCC1N MCULE-5593863466 [0,1,0,0,1,0|1,0,0]=3 4324 B9R1.41 NC(=O)C1CCCC1N MCULE-7208597206 [0,1,0,0,1,0|1,0,0]=3 4325 B9R1.41 NC(=O)C1NCCC1O MCULE-1947851170 [0,1,0,0,1,0|1,0,0]=3 4326 B9R1.41 NC(=O)C1NCCC1O MCULE-8983481897 [0,1,0,0,1,0|1,0,0]=3 4327 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-1275176642 [0,1,0,0,1,0|1,0,0]=3 4328 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2107283008 [0,1,0,0,1,0|1,0,0]=3 4329 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2865532845 [0,1,0,0,1,0|1,0,0]=3 4330 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-3874121291 [0,1,0,0,1,0|1,0,0]=3 4331 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O MCULE-7290076922 [0,1,0,0,1,0|1,0,0]=3 4332 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-1119399523 [0,1,0,0,1,0|1,0,0]=3 4333 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-4733398267 [0,1,0,0,1,0|1,0,0]=3 4334 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8085547151 [0,1,0,0,1,0|1,0,0]=3 4335 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8491779714 [0,1,0,0,1,0|1,0,0]=3 4336 B9R1.41 NC1=C(CCC1)C(=O)O MCULE-9287668193 [0,1,0,0,1,0|0,0,2]=4 4337 B9R1.41 NC1C=CCC1C(=O)O MCULE-8527386281 [0,1,0,0,1,0|0,0,2]=4 4338 B9R1.41 NC1C=CCC1C(=O)O MCULE-8529743719 [0,1,0,0,1,0|0,0,2]=4 4339 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [0,1,0,0,1,0|0,0,0]=2 4340 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [0,1,0,0,1,0|0,0,0]=2 4341 B9R1.41 NC1CCNC1C(=O)O MCULE-3789976956 [0,1,0,0,1,0|0,0,0]=2 4342 B9R1.41 NC1CCNC1C(=O)O MCULE-5356536056 [0,1,0,0,1,0|0,0,0]=2 4343 B9R1.41 NC1CNCC1C(=O)O MCULE-1244086282 [0,1,0,0,1,0|0,0,0]=2 4344 B9R1.41 NC1COCC1C(=O)O MCULE-7325840275 [0,1,0,0,1,0|1,0,0]=3 4345 B9R1.41 NC1COCC1C(=O)O MCULE-9068897815 [0,1,0,0,1,0|1,0,0]=3 4346 B9R1.41 NN1CCCC1C(=O)O MCULE-1374834183 [0,1,0,0,1,0|0,0,0]=2 4347 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [0,1,0,0,1,0|0,0,0]=2 4348 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [0,1,0,0,1,0|0,0,0]=2 4349 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [0,1,0,0,1,0|0,0,0]=2 4350 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [0,1,0,0,1,0|0,0,0]=2 4351 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [0,1,0,0,1,0|0,0,0]=2 4352 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [0,1,0,0,1,0|0,0,0]=2 4353 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [0,1,0,0,1,0|0,0,0]=2 4354 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [0,1,0,0,1,0|0,0,0]=2 4355 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-1080605796 [0,1,0,0,1,0|0,0,0]=2 4356 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5666272526 [0,1,0,0,1,0|0,0,0]=2 4357 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5723263979 [0,1,0,0,1,0|0,0,0]=2 4358 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-6574312344 [0,1,0,0,1,0|0,0,0]=2 4359 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O MCULE-9833243208 [0,1,0,0,1,0|1,0,0]=3 4360 B9R1.41 N[C@@H]1COC[C@H]1C(=O)O MCULE-7323429960 [0,1,0,0,1,0|1,0,0]=3 4361 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [0,1,0,0,1,0|0,0,0]=2 4362 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [0,1,0,0,1,0|0,0,0]=2 4363 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [0,1,0,0,1,0|0,0,0]=2 4364 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [0,1,0,0,1,0|0,0,0]=2 4365 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [0,1,0,0,1,0|0,0,0]=2 4366 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [0,1,0,0,1,0|0,0,0]=2 4367 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [0,1,0,0,1,0|0,0,0]=2 4368 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [0,1,0,0,1,0|0,0,0]=2 4369 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [0,1,0,0,1,0|0,0,0]=2 4370 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [0,1,0,0,1,0|0,0,0]=2 4371 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-4396526735 [0,1,0,0,1,0|1,0,0]=3 4372 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-9025415433 [0,1,0,0,1,0|1,0,0]=3 4373 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-2956846972 [0,1,0,0,1,0|1,0,0]=3 4374 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-3321988270 [0,1,0,0,1,0|1,0,0]=3 4375 B9R1.41 O=C(Cl)C1CCCC1=O MCULE-1186628152 [0,1,0,0,1,0|1,0,1]=4 4376 B9R1.41 O=C(O)C1=C(CCC1)Cl MCULE-4349801654 [0,1,0,0,1,0|0,0,2]=4 4377 B9R1.41 O=C(O)C1CCCC1=O MCULE-9500236289 [0,1,0,0,1,0|0,0,1]=3 4378 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [0,1,0,0,1,0|0,0,0]=2 4379 B9R1.41 O=C(O)C1CCNC1=O MCULE-3110303122 [0,1,0,0,1,0|0,0,1]=3 4380 B9R1.41 O=C(O)C1CCOC1=O MCULE-1545162383 [0,1,0,0,1,0|1,0,1]=4 4381 B9R1.41 O=C(O)C1CNCC1O MCULE-4948062518 [0,1,0,0,1,0|0,0,0]=2 4382 B9R1.41 O=C(O)C1CNCC1O MCULE-8113161890 [0,1,0,0,1,0|0,0,0]=2 4383 B9R1.41 O=C(O)C1COCC1F MCULE-8830875984 [0,1,0,0,1,0|1,0,0]=3 4384 B9R1.41 O=C(O)C1CSCC1=O MCULE-2401489071 [0,1,0,0,1,0|1,0,1]=4 4385 B9R1.41 O=C(O)C1NCCC1F MCULE-2108063646 [0,1,0,0,1,0|0,0,0]=2 4386 B9R1.41 O=C(O)C1NCCC1F MCULE-6901343291 [0,1,0,0,1,0|0,0,0]=2 4387 B9R1.41 O=C(O)C1NCCC1O MCULE-3415911467 [0,1,0,0,1,0|0,0,0]=2 4388 B9R1.41 O=C(O)C1NCCC1O MCULE-3678949962 [0,1,0,0,1,0|0,0,0]=2 4389 B9R1.41 O=C(O)C1NCCC1O MCULE-6594922763 [0,1,0,0,1,0|0,0,0]=2 4390 B9R1.41 O=C(O)N1CCNC1=O MCULE-2423498210 [0,1,0,0,1,0|1,0,1]=4 4391 B9R1.41 O=C(O)[C@@H]1CCNC1=O MCULE-2092808645 [0,1,0,0,1,0|0,0,1]=3 4392 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-3174474393 [0,1,0,0,1,0|0,0,0]=2 4393 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-5151888407 [0,1,0,0,1,0|0,0,0]=2 4394 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1216340314 [0,1,0,0,1,0|0,0,0]=2 4395 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1564327038 [0,1,0,0,1,0|0,0,0]=2 4396 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-8208546333 [0,1,0,0,1,0|0,0,0]=2 4397 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9489383113 [0,1,0,0,1,0|0,0,0]=2 4398 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9999937302 [0,1,0,0,1,0|0,0,0]=2 4399 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7001095632 [0,1,0,0,1,0|0,0,0]=2 4400 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7931619369 [0,1,0,0,1,0|0,0,0]=2 4401 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-1637514285 [0,1,0,0,1,0|0,0,0]=2 4402 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-7041138309 [0,1,0,0,1,0|0,0,0]=2 4403 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9174140225 [0,1,0,0,1,0|0,0,0]=2 4404 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9867563873 [0,1,0,0,1,0|0,0,0]=2 4405 B9R1.41 O=C(O)[C@@H]1[NH2+]CC[C@@H]1O MCULE-4350473030 [0,1,0,0,1,0|0,0,1]=3 4406 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [0,1,0,0,1,0|0,0,0]=2 4407 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-1175817797 [0,1,0,0,1,0|0,0,0]=2 4408 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-5823079222 [0,1,0,0,1,0|0,0,0]=2 4409 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-6437141041 [0,1,0,0,1,0|0,0,0]=2 4410 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-8496599400 [0,1,0,0,1,0|0,0,0]=2 4411 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-1891620706 [0,1,0,0,1,0|0,0,0]=2 4412 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2757873569 [0,1,0,0,1,0|0,0,0]=2 4413 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2760733859 [0,1,0,0,1,0|0,0,0]=2 4414 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F MCULE-8117073613 [0,1,0,0,1,0|0,0,0]=2 4415 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-2253713572 [0,1,0,0,1,0|0,0,0]=2 4416 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-4523708371 [0,1,0,0,1,0|0,0,0]=2 4417 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6240521801 [0,1,0,0,1,0|0,0,0]=2 4418 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6709232399 [0,1,0,0,1,0|0,0,0]=2 4419 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6746975985 [0,1,0,0,1,0|0,0,0]=2 4420 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-8268334758 [0,1,0,0,1,0|0,0,0]=2 4421 B9R1.41 [C@@H]1(CCN[C@H]1C(=O)O)O MCULE-2060265421 [0,1,0,0,1,0|0,0,0]=2 4422 B9R1.41 [C@@H]1(NCC[C@H]1O)C(=O)O MCULE-1208236317 [0,1,0,0,1,0|0,0,0]=2 4423 B9R1.41 [C@H]1(CCN[C@H]1C(=O)O)O MCULE-3906438921 [0,1,0,0,1,0|0,0,0]=2 4424 B9R1.163 CC(=O)C1(CCCC1)C MCULE-7946764519 [0,1,0,0,1,0|1,0,0]=3 4425 B9R1.163 CC(=O)C1(CCCC1)N MCULE-1766488888 [0,1,0,0,1,0|1,0,0]=3 4426 B9R1.163 CC(=O)C1(CCCC1)N MCULE-2390313394 [0,1,0,0,1,0|1,0,0]=3 4427 B9R1.163 CC(=O)C1(CCCC1)O MCULE-4607553416 [0,1,0,0,1,0|1,0,0]=3 4428 B9R1.163 CC(=O)C1(CCCO1)C MCULE-3832225855 [0,1,0,0,1,0|2,0,0]=4 4429 B9R1.163 CC1(C=CCC1)C(=O)O MCULE-5900825388 [0,1,0,0,1,0|0,0,2]=4 4430 B9R1.163 CC1(CC=CC1)C(=O)O MCULE-6612456038 [0,1,0,0,1,0|0,0,2]=4 4431 B9R1.163 CC1(CCCC1)C(=O)Cl MCULE-6905026517 [0,1,0,0,1,0|1,0,0]=3 4432 B9R1.163 CC1(CCCC1)C(=O)O MCULE-8150530718 [0,1,0,0,1,0|0,0,0]=2 4433 B9R1.163 CC1(CCCN1)C(=O)N MCULE-1073156492 [0,1,0,0,1,0|1,0,0]=3 4434 B9R1.163 CC1(CCCN1)C(=O)N MCULE-4207908355 [0,1,0,0,1,0|1,0,0]=3 4435 B9R1.163 CC1(CCCN1)C(=O)N MCULE-5102556329 [0,1,0,0,1,0|1,0,0]=3 4436 B9R1.163 CC1(CCCN1)C(=O)O MCULE-2669113714 [0,1,0,0,1,0|0,0,0]=2 4437 B9R1.163 CC1(CCCN1)C(=O)O MCULE-3184723558 [0,1,0,0,1,0|0,0,0]=2 4438 B9R1.163 CC1(CCCN1)C(=O)O MCULE-5494365974 [0,1,0,0,1,0|0,0,0]=2 4439 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9532642299 [0,1,0,0,1,0|0,0,0]=2 4440 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9805069526 [0,1,0,0,1,0|0,0,0]=2 4441 B9R1.163 CC1(CCCO1)C(=O)O MCULE-9576233735 [0,1,0,0,1,0|1,0,0]=3 4442 B9R1.163 CC1(CCCS1)C(=O)O MCULE-3409370715 [0,1,0,0,1,0|1,0,0]=3 4443 B9R1.163 CC1(CCNC1)C(=O)N MCULE-9618767565 [0,1,0,0,1,0|1,0,0]=3 4444 B9R1.163 CC1(CCNC1)C(=O)O MCULE-2715430873 [0,1,0,0,1,0|0,0,0]=2 4445 B9R1.163 CC1(CCNC1)C(=O)O MCULE-4084355022 [0,1,0,0,1,0|0,0,0]=2 4446 B9R1.163 CC1(CCOC1)C(=O)O MCULE-6893882009 [0,1,0,0,1,0|1,0,0]=3 4447 B9R1.163 CC1(CSSC1)C(=O)O MCULE-1267186189 [0,1,0,0,1,0|2,0,0]=4 4448 B9R1.163 CC1(NCCS1)C(=O)O MCULE-3303237869 [0,1,0,0,1,0|1,0,0]=3 4449 B9R1.163 CC1(OCCO1)C(=O)O MCULE-6576803543 [0,1,0,0,1,0|2,0,0]=4 4450 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-2607591453 [0,1,0,0,1,0|0,0,0]=2 4451 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-6141960789 [0,1,0,0,1,0|0,0,0]=2 4452 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-7011144386 [0,1,0,0,1,0|0,0,0]=2 4453 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-8922118927 [0,1,0,0,1,0|0,0,0]=2 4454 B9R1.163 C[C@@]1(CCCO1)C(=O)O MCULE-5169117592 [0,1,0,0,1,0|1,0,0]=3 4455 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3070355045 [0,1,0,0,1,0|0,0,0]=2 4456 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3719506215 [0,1,0,0,1,0|0,0,0]=2 4457 B9R1.163 C[C@@]1(CCOC1)C(=O)O MCULE-5585882923 [0,1,0,0,1,0|1,0,0]=3 4458 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-4783754920 [0,1,0,0,1,0|1,0,0]=3 4459 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-7441682522 [0,1,0,0,1,0|1,0,0]=3 4460 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-8011663424 [0,1,0,0,1,0|1,0,0]=3 4461 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-6724020872 [0,1,0,0,1,0|0,0,0]=2 4462 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-7675502884 [0,1,0,0,1,0|0,0,0]=2 4463 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-8343149548 [0,1,0,0,1,0|0,0,0]=2 4464 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-9260269719 [0,1,0,0,1,0|0,0,0]=2 4465 B9R1.163 C[C@]1(CCCO1)C(=O)O MCULE-3910400790 [0,1,0,0,1,0|1,0,0]=3 4466 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-1423230640 [0,1,0,0,1,0|0,0,0]=2 4467 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-7327407576 [0,1,0,0,1,0|0,0,0]=2 4468 B9R1.163 NC(=O)C1(CCCC1)N MCULE-1603183997 [0,1,0,0,1,0|1,0,0]=3 4469 B9R1.163 NC(=O)C1(CCCC1)N MCULE-6535833155 [0,1,0,0,1,0|1,0,0]=3 4470 B9R1.163 NC(=O)C1(CCCC1)O MCULE-7750018506 [0,1,0,0,1,0|1,0,0]=3 4471 B9R1.163 NC(=O)C1(CCNC1)F MCULE-2967472132 [0,1,0,0,1,0|1,0,0]=3 4472 B9R1.163 NC(=O)C1(CCNC1)O MCULE-3402125568 [0,1,0,0,1,0|1,0,0]=3 4473 B9R1.163 NC(=O)C1(CCNC1)O MCULE-4107989965 [0,1,0,0,1,0|1,0,0]=3 4474 B9R1.163 NC(=O)C1(CCSC1)N MCULE-1255795217 [0,1,0,0,1,0|2,0,0]=4 4475 B9R1.163 NC(=O)C1(CCSC1)O MCULE-2351837625 [0,1,0,0,1,0|2,0,0]=4 4476 B9R1.163 NC(=S)C1(CCCC1)N MCULE-1374309481 [0,1,0,0,1,0|1,1,0]=4 4477 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-1445980877 [0,1,0,0,1,0|0,0,2]=4 4478 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-5381827504 [0,1,0,0,1,0|0,0,2]=4 4479 B9R1.163 NC1(CCCC1)C(=O)O MCULE-6366286422 [0,1,0,0,1,0|0,0,0]=2 4480 B9R1.163 NC1(CCNC1)C(=O)O MCULE-1061035749 [0,1,0,0,1,0|0,0,0]=2 4481 B9R1.163 NC1(CCOC1)C(=O)O MCULE-1020331216 [0,1,0,0,1,0|1,0,0]=3 4482 B9R1.163 NC1(CCOC1)C(=O)O MCULE-3239849151 [0,1,0,0,1,0|1,0,0]=3 4483 B9R1.163 NC1(CCOC1)C(=O)O MCULE-7635316557 [0,1,0,0,1,0|1,0,0]=3 4484 B9R1.163 NC1(CCSC1)C(=O)O MCULE-2866413498 [0,1,0,0,1,0|1,0,0]=3 4485 B9R1.163 NC1(CCSC1)C(=O)O MCULE-3077570702 [0,1,0,0,1,0|1,0,0]=3 4486 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-4940789798 [0,1,0,0,1,0|1,0,0]=3 4487 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-9120207414 [0,1,0,0,1,0|1,0,0]=3 4488 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-3449072625 [0,1,0,0,1,0|1,0,0]=3 4489 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-6533506498 [0,1,0,0,1,0|1,0,0]=3 4490 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-5112163951 [0,1,0,0,1,0|0,0,0]=2 4491 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-7065442028 [0,1,0,0,1,0|0,0,0]=2 4492 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-6757422211 [0,1,0,0,1,0|1,0,0]=3 4493 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-8786481856 [0,1,0,0,1,0|1,0,0]=3 4494 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1832449395 [0,1,0,0,1,0|1,0,0]=3 4495 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1974139646 [0,1,0,0,1,0|1,0,0]=3 4496 B9R1.163 O=C(O)C1(CCCC1)Br MCULE-3131005284 [0,1,0,0,1,0|0,0,0]=2 4497 B9R1.163 O=C(O)C1(CCCC1)F MCULE-4282263280 [0,1,0,0,1,0|0,0,0]=2 4498 B9R1.163 O=C(O)C1(CCCC1)O MCULE-2147028492 [0,1,0,0,1,0|0,0,0]=2 4499 B9R1.163 O=C(O)C1(CCNC1)F MCULE-3943818123 [0,1,0,0,1,0|0,0,0]=2 4500 B9R1.163 O=C(O)C1(CCNC1)F MCULE-9385624346 [0,1,0,0,1,0|0,0,0]=2 4501 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5890399768 [0,1,0,0,1,0|0,0,0]=2 4502 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5910869185 [0,1,0,0,1,0|0,0,0]=2 4503 B9R1.163 O=C(O)C1(CCOC1)F MCULE-5718551369 [0,1,0,0,1,0|1,0,0]=3 4504 B9R1.163 O=C(O)C1(CCOC1)O MCULE-8834969992 [0,1,0,0,1,0|1,0,0]=3 4505 B9R1.163 O=C(O)C1(CCSC1)O MCULE-7477879136 [0,1,0,0,1,0|1,0,0]=3 4506 B9R1.163 O=C(O)[C@@]1(CCNC1)F MCULE-8296048165 [0,1,0,0,1,0|0,0,0]=2 4507 B11R1.20 CC(=O)NC1CCC(CC1)Br MCULE-2714205732 [0,1,0,0,0,1|2,0,0]=4 4508 B11R1.20 CC(=O)NC1CCC(CC1)Cl MCULE-5458062636 [0,1,0,0,0,1|2,0,0]=4 4509 B11R1.20 CC(=O)NC1CCC(CC1)I MCULE-8279325770 [0,1,0,0,0,1|2,0,0]=4 4510 B11R1.20 CC(=O)NC1CCC(CC1)N MCULE-1813203200 [0,1,0,0,0,1|2,0,0]=4 4511 B11R1.20 CC(=O)NC1CCC(CC1)N MCULE-9889880416 [0,1,0,0,0,1|2,0,0]=4 4512 B11R1.20 CC(=O)NC1CCC(CC1)O MCULE-4935359894 [0,1,0,0,0,1|2,0,0]=4 4513 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)C MCULE-8580957881 [0,1,0,0,0,1|2,0,0]=4 4514 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)N MCULE-4250787839 [0,1,0,0,0,1|2,0,0]=4 4515 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)N MCULE-6663619510 [0,1,0,0,0,1|2,0,0]=4 4516 B11R1.20 CC(=O)N[C@H]1CC[C@@H](CC1)O MCULE-7696004406 [0,1,0,0,0,1|2,0,0]=4 4517 B11R1.20 CC(=O)N[C@H]1CC[C@H](CC1)C MCULE-5716808523 [0,1,0,0,0,1|2,0,0]=4 4518 B11R1.20 CC1CCC(=CC(=O)O)CC1 MCULE-3219235277 [0,1,0,0,0,1|1,0,1]=4 4519 B11R1.20 CC1CCC(CC1)CC(=O)O MCULE-4709512543 [0,1,0,0,0,1|1,0,0]=3 4520 B11R1.20 CC1CCN(CC1)CC(=O)O MCULE-3374231759 [0,1,0,0,0,1|2,0,0]=4 4521 B11R1.20 CC1CCN(CC1)CC(=O)O MCULE-5790933306 [0,1,0,0,0,1|2,0,0]=4 4522 B11R1.20 CN1CCC(CC1)CC(=O)O MCULE-5663210558 [0,1,0,0,0,1|2,0,0]=4 4523 B11R1.20 CN1CCC(CC1)CC(=O)O MCULE-8825370932 [0,1,0,0,0,1|2,0,0]=4 4524 B11R1.20 C[C@H]1CC[C@@H](CC1)CC(=O)O MCULE-6731009022 [0,1,0,0,0,1|1,0,0]=3 4525 B11R1.20 NC(=O)C[C@H]1CC[C@@H](CC1)N MCULE-3811015580 [0,1,0,0,0,1|2,0,0]=4 4526 B11R1.20 NC(=O)C[C@H]1CC[C@@H](CC1)N MCULE-5508464432 [0,1,0,0,0,1|2,0,0]=4 4527 B11R1.20 NC(=O)NC1CCC(CC1)O MCULE-8332331754 [0,1,0,0,0,1|2,0,0]=4 4528 B11R1.20 NC1CCC(CC1)CC(=O)O MCULE-7784789459 [0,1,0,0,0,1|1,0,0]=3 4529 B11R1.20 NC1CCN(CC1)CC(=O)O MCULE-1681948264 [0,1,0,0,0,1|2,0,0]=4 4530 B11R1.20 NC1CCN(CC1)CC(=O)O MCULE-3213132372 [0,1,0,0,0,1|2,0,0]=4 4531 B11R1.20 NC1CCN(CC1)CC(=O)O MCULE-6377882759 [0,1,0,0,0,1|2,0,0]=4 4532 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O MCULE-2303304803 [0,1,0,0,0,1|1,0,0]=3 4533 B11R1.20 N[C@H]1CC[C@@H](CC1)CC(=O)O MCULE-5990177555 [0,1,0,0,0,1|1,0,0]=3 4534 B11R1.20 N[C@H]1CC[C@H](CC1)CC(=O)O MCULE-4302933877 [0,1,0,0,0,1|1,0,0]=3 4535 B11R1.20 N[C@H]1CC[C@H](CC1)CC(=O)O MCULE-7773137329 [0,1,0,0,0,1|1,0,0]=3 4536 B11R1.20 O=C(O)CC1CCC(=O)CC1 MCULE-2016363878 [0,1,0,0,0,1|1,0,1]=4 4537 B11R1.20 O=C(O)CC1CCC(=O)NC1 MCULE-8185955859 [0,1,0,0,0,1|0,0,1]=3 4538 B11R1.20 O=C(O)CC1CCC(CC1)Cl MCULE-8089546058 [0,1,0,0,0,1|1,0,0]=3 4539 B11R1.20 O=C(O)CC1CCC(CC1)O MCULE-4327900578 [0,1,0,0,0,1|1,0,0]=3 4540 B11R1.20 O=C(O)CN1CCC(CC1)Br MCULE-2602154230 [0,1,0,0,0,1|2,0,0]=4 4541 B11R1.20 O=C(O)CN1CCC(CC1)Cl MCULE-1319189371 [0,1,0,0,0,1|2,0,0]=4 4542 B11R1.20 O=C(O)CN1CCC(CC1)I MCULE-9445005892 [0,1,0,0,0,1|2,0,0]=4 4543 B11R1.20 O=C(O)CN1CCC(CC1)O MCULE-6234398101 [0,1,0,0,0,1|2,0,0]=4 4544 B11R1.20 O=C(O)C[C@H]1CC[C@@H](CC1)O MCULE-4456637498 [0,1,0,0,0,1|1,0,0]=3 4545 B11R1.20 O=C(O)C[C@H]1CC[C@H](CC1)O MCULE-7150660975 [0,1,0,0,0,1|1,0,0]=3 4546 B11R1.20 [NH3+]C1CCC(CC1)CC(=O)O MCULE-6083129512 [0,1,0,0,0,1|1,0,0]=3 4547 B11R1.36 C1(CCCNC1)N(C)C(=O)C MCULE-1802157504 [0,1,0,0,0,1|1,0,0]=3 4548 B11R1.36 CC(=C1CCCCC1)C(=O)O MCULE-5916603018 [0,1,0,0,0,1|1,0,1]=4 4549 B11R1.36 CC(=O)C(C)C1CCCCC1 MCULE-9060961966 [0,1,0,0,0,1|2,0,0]=4 4550 B11R1.36 CC(=O)N(C)C1CCCNC1 MCULE-3869365516 [0,1,0,0,0,1|1,0,0]=3 4551 B11R1.36 CC(=O)N(C)C1CCCNC1 MCULE-5701202667 [0,1,0,0,0,1|1,0,0]=3 4552 B11R1.36 CC(=O)N(C)[C@@H]1CCCNC1 MCULE-2065490417 [0,1,0,0,0,1|1,0,0]=3 4553 B11R1.36 CC(=O)N(C)[C@@H]1CCCNC1 MCULE-8429913670 [0,1,0,0,0,1|1,0,0]=3 4554 B11R1.36 CC(=O)N(C)[C@@H]1CCCNC1 MCULE-8492000691 [0,1,0,0,0,1|1,0,0]=3 4555 B11R1.36 CC(=O)N(C)[C@@H]1CCCNC1 MCULE-9337437561 [0,1,0,0,0,1|1,0,0]=3 4556 B11R1.36 CC(=O)N(C)[C@H]1CCCNC1 MCULE-4371606309 [0,1,0,0,0,1|1,0,0]=3 4557 B11R1.36 CC(=O)N(C)[C@H]1CCCNC1 MCULE-4487840205 [0,1,0,0,0,1|1,0,0]=3 4558 B11R1.36 CC(=O)N(C)[C@H]1CCCNC1 MCULE-9965896221 [0,1,0,0,0,1|1,0,0]=3 4559 B11R1.36 CC(C(=O)O)C1CCCCC1 MCULE-7073762782 [0,1,0,0,0,1|1,0,0]=3 4560 B11R1.36 CC(C(=O)O)C1CCNCC1 MCULE-1056232308 [0,1,0,0,0,1|2,0,0]=4 4561 B11R1.36 CC(C(=O)O)C1CCNCC1 MCULE-9936644185 [0,1,0,0,0,1|2,0,0]=4 4562 B11R1.36 CC(C(=O)O)C1CCOCC1 MCULE-2495920353 [0,1,0,0,0,1|2,0,0]=4 4563 B11R1.36 CC(C(=O)O)N1CCCCC1 MCULE-8781256011 [0,1,0,0,0,1|2,0,0]=4 4564 B11R1.36 CC(C(=O)O)N1CCCCC1 MCULE-9082142746 [0,1,0,0,0,1|2,0,0]=4 4565 B11R1.36 CN(C(=O)Cl)C1CCCCC1 MCULE-2444398289 [0,1,0,0,0,1|2,0,0]=4 4566 B11R1.36 C[C@@H](C(=O)O)C1CCCCC1 MCULE-1380670662 [0,1,0,0,0,1|1,0,0]=3 4567 B11R1.36 C[C@H](C(=O)O)C1CCCCC1 MCULE-6704404403 [0,1,0,0,0,1|1,0,0]=3 4568 B11R1.36 NC(=O)C(N)C1CCCCC1 MCULE-4289358018 [0,1,0,0,0,1|2,0,0]=4 4569 B11R1.36 NC(C(=O)O)C1CC=CCC1 MCULE-8998480466 [0,1,0,0,0,1|1,0,1]=4 4570 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-1846014205 [0,1,0,0,0,1|1,0,0]=3 4571 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-2033801873 [0,1,0,0,0,1|1,0,0]=3 4572 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-4412820367 [0,1,0,0,0,1|1,0,0]=3 4573 B11R1.36 NC(C(=O)O)C1CCCCC1 MCULE-6865831162 [0,1,0,0,0,1|1,0,0]=3 4574 B11R1.36 NC(C(=O)O)C1CCCCN1 MCULE-4787612648 [0,1,0,0,0,1|2,0,0]=4 4575 B11R1.36 NC(C(=O)O)C1CCCCN1 MCULE-7916436523 [0,1,0,0,0,1|2,0,0]=4 4576 B11R1.36 NC(C(=O)O)C1CCCNC1 MCULE-5536275038 [0,1,0,0,0,1|0,0,0]=2 4577 B11R1.36 NC(C(=O)O)C1CCCOC1 MCULE-6641388094 [0,1,0,0,0,1|1,0,0]=3 4578 B11R1.36 NC(C(=O)O)C1CCOCC1 MCULE-3326635011 [0,1,0,0,0,1|2,0,0]=4 4579 B11R1.36 NC(C(=O)O)C1CCOCC1 MCULE-5860428330 [0,1,0,0,0,1|2,0,0]=4 4580 B11R1.36 NC(C(=O)O)C1CCOCC1 MCULE-9241993616 [0,1,0,0,0,1|2,0,0]=4 4581 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-3443210425 [0,1,0,0,0,1|1,0,0]=3 4582 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-4731070853 [0,1,0,0,0,1|1,0,0]=3 4583 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-6698336499 [0,1,0,0,0,1|1,0,0]=3 4584 B11R1.36 N[C@@H](C(=O)O)C1CCCCC1 MCULE-6855404620 [0,1,0,0,0,1|1,0,0]=3 4585 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 MCULE-4067475583 [0,1,0,0,0,1|2,0,0]=4 4586 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 MCULE-4605949678 [0,1,0,0,0,1|2,0,0]=4 4587 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 MCULE-7160845829 [0,1,0,0,0,1|2,0,0]=4 4588 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 MCULE-8127248642 [0,1,0,0,0,1|2,0,0]=4 4589 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-1545974835 [0,1,0,0,0,1|1,0,0]=3 4590 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-1933038118 [0,1,0,0,0,1|1,0,0]=3 4591 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-2164840222 [0,1,0,0,0,1|1,0,0]=3 4592 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-9858528992 [0,1,0,0,0,1|1,0,0]=3 4593 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 MCULE-9914793144 [0,1,0,0,0,1|1,0,0]=3 4594 B11R1.36 N[C@H](C(=O)O)C1CCNCC1 MCULE-3998200055 [0,1,0,0,0,1|2,0,0]=4 4595 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 MCULE-2693360453 [0,1,0,0,0,1|2,0,0]=4 4596 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 MCULE-5518278339 [0,1,0,0,0,1|2,0,0]=4 4597 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 MCULE-9024352263 [0,1,0,0,0,1|2,0,0]=4 4598 B11R1.36 O=C(O)C(=C1CCCCC1)F MCULE-3891003655 [0,1,0,0,0,1|1,0,1]=4 4599 B11R1.36 O=C(O)C(=O)C1CCCCC1 MCULE-8959024132 [0,1,0,0,0,1|1,0,0]=3 4600 B11R1.36 O=C(O)C(=O)C1CCOCC1 MCULE-3496647241 [0,1,0,0,0,1|2,0,0]=4 4601 B11R1.36 O=C(O)C(=O)N1CCCCC1 MCULE-8703593629 [0,1,0,0,0,1|2,0,0]=4 4602 B11R1.36 O=C(O)C(=O)[C@H]1CC=CCC1 MCULE-2654807200 [0,1,0,0,0,1|1,0,1]=4 4603 B11R1.36 O=C(O)C(F)C1CCCCC1 MCULE-1489080540 [0,1,0,0,0,1|1,0,0]=3 4604 B11R1.36 O=C(O)C(F)C1CCOCC1 MCULE-4691952590 [0,1,0,0,0,1|2,0,0]=4 4605 B11R1.36 O=C(O)C(O)C1CCCCC1 MCULE-1137791149 [0,1,0,0,0,1|1,0,0]=3 4606 B11R1.36 O=C(O)C(O)C1CCCNC1 MCULE-1767872209 [0,1,0,0,0,1|0,0,0]=2 4607 B11R1.36 O=C(O)C(O)C1CCCNC1 MCULE-6745265789 [0,1,0,0,0,1|0,0,0]=2 4608 B11R1.36 O=C(O)C(O)C1CCOCC1 MCULE-5923962415 [0,1,0,0,0,1|2,0,0]=4 4609 B11R1.36 O=C(O)[C@@H](O)C1CCCCC1 MCULE-2724503390 [0,1,0,0,0,1|1,0,0]=3 4610 B11R1.36 O=C(O)[C@@H](O)C1CCCCC1 MCULE-6659758826 [0,1,0,0,0,1|1,0,0]=3 4611 B11R1.36 O=C(O)[C@@H](O)C1CCOCC1 MCULE-6979522096 [0,1,0,0,0,1|2,0,0]=4 4612 B11R1.36 O=C(O)[C@H](O)C1CCCCC1 MCULE-2949323528 [0,1,0,0,0,1|1,0,0]=3 4613 B11R1.36 O=C(O)[C@H](O)C1CCCCC1 MCULE-3804932181 [0,1,0,0,0,1|1,0,0]=3 4614 B11R1.36 [C@@H]1(CCCNC1)C(N)C(=O)O MCULE-6149074850 [0,1,0,0,0,1|0,0,0]=2 4615 B11R1.36 [C@@H]1(CCCNC1)[C@@H](N)C(=O)O MCULE-7684614655 [0,1,0,0,0,1|0,0,0]=2 4616 B11R1.36 [C@@H]1(CCCNC1)[C@H](N)C(=O)O MCULE-3256486770 [0,1,0,0,0,1|0,0,0]=2 4617 B11R1.36 [C@H](N)(C(=O)O)C1CCCCC1 MCULE-2416228483 [0,1,0,0,0,1|1,0,0]=3 4618 B11R1.36 [C@H]1(CCCNC1)C(N)C(=O)O MCULE-3096261009 [0,1,0,0,0,1|0,0,0]=2 4619 B11R1.36 [C@H]1(CCCNC1)[C@@H](N)C(=O)O MCULE-7922011516 [0,1,0,0,0,1|0,0,0]=2 4620 B11R1.36 [C@H]1(CCCNC1)[C@H](N)C(=O)O MCULE-6518139620 [0,1,0,0,0,1|0,0,0]=2 4621 B11R1.40 C#CC(=O)NC1CCCCC1 MCULE-5426368985 [0,1,0,0,0,1|2,0,0]=4 4622 B11R1.40 C=CC(=O)NC1CCCCC1 MCULE-3177684099 [0,1,0,0,0,1|2,0,0]=4 4623 B11R1.40 C=CC(=O)OC1CCCCC1 MCULE-9685244438 [0,1,0,0,0,1|2,0,0]=4 4624 B11R1.40 CCC(=O)CC1CCCCC1 MCULE-4548371264 [0,1,0,0,0,1|2,0,0]=4 4625 B11R1.40 CCC(=O)NC1CCCCC1 MCULE-3419977107 [0,1,0,0,0,1|2,0,0]=4 4626 B11R1.40 CCC(=O)NC1CCCNC1 MCULE-6304805744 [0,1,0,0,0,1|1,0,0]=3 4627 B11R1.40 CCC(=O)NC1CCCNC1 MCULE-9496785830 [0,1,0,0,0,1|1,0,0]=3 4628 B11R1.40 CCC(=O)N[C@@H]1CCCNC1 MCULE-6233916001 [0,1,0,0,0,1|1,0,0]=3 4629 B11R1.40 CCC(=O)N[C@@H]1CCCNC1 MCULE-9800857840 [0,1,0,0,0,1|1,0,0]=3 4630 B11R1.40 CCC(=O)N[C@H]1CCCNC1 MCULE-4548926629 [0,1,0,0,0,1|1,0,0]=3 4631 B11R1.40 CCC(=O)N[C@H]1CCCNC1 MCULE-5937980946 [0,1,0,0,0,1|1,0,0]=3 4632 B11R1.40 CCC(=O)OC1CCCCC1 MCULE-4878482925 [0,1,0,0,0,1|2,0,0]=4 4633 B11R1.40 CCC(=O)OC1CCCNC1 MCULE-2681504639 [0,1,0,0,0,1|1,0,0]=3 4634 B11R1.40 CCC(=O)OC1CCCNC1 MCULE-4017551904 [0,1,0,0,0,1|1,0,0]=3 4635 B11R1.40 CNC(=O)CC1CCCCC1 MCULE-6265234454 [0,1,0,0,0,1|2,0,0]=4 4636 B11R1.40 CNC(=O)NC1CCCCC1 MCULE-1669953265 [0,1,0,0,0,1|2,0,0]=4 4637 B11R1.40 CNC(=O)NC1CCCNC1 MCULE-1067475248 [0,1,0,0,0,1|1,0,0]=3 4638 B11R1.40 CNC(=O)NC1CCCNC1 MCULE-9095541115 [0,1,0,0,0,1|1,0,0]=3 4639 B11R1.40 CNC(=O)NC1CCCNC1 MCULE-9615166363 [0,1,0,0,0,1|1,0,0]=3 4640 B11R1.40 CNC(=O)N[C@@H]1CCCNC1 MCULE-5018900018 [0,1,0,0,0,1|1,0,0]=3 4641 B11R1.40 CNC(=O)N[C@@H]1CCCNC1 MCULE-5541257418 [0,1,0,0,0,1|1,0,0]=3 4642 B11R1.40 CNC(=O)N[C@H]1CCCNC1 MCULE-6273220823 [0,1,0,0,0,1|1,0,0]=3 4643 B11R1.40 CNC(=O)N[C@H]1CCCNC1 MCULE-8867257141 [0,1,0,0,0,1|1,0,0]=3 4644 B11R1.40 COC(=O)C=C1CCCCC1 MCULE-4895716264 [0,1,0,0,0,1|1,0,1]=4 4645 B11R1.40 COC(=O)C=C1CCCOC1 MCULE-4989506759 [0,1,0,0,0,1|1,0,1]=4 4646 B11R1.40 COC(=O)CC1CCCCC1 MCULE-4749534991 [0,1,0,0,0,1|1,0,0]=3 4647 B11R1.40 COC(=O)CC1CCCCN1 MCULE-1659624694 [0,1,0,0,0,1|2,0,0]=4 4648 B11R1.40 COC(=O)CC1CCCCN1 MCULE-5592891926 [0,1,0,0,0,1|2,0,0]=4 4649 B11R1.40 COC(=O)CC1CCCNC1 MCULE-2894207855 [0,1,0,0,0,1|0,0,0]=2 4650 B11R1.40 COC(=O)CC1CCCNC1 MCULE-8539590471 [0,1,0,0,0,1|0,0,0]=2 4651 B11R1.40 COC(=O)CC1CCNCC1 MCULE-4818273917 [0,1,0,0,0,1|2,0,0]=4 4652 B11R1.40 COC(=O)CC1CCNCC1 MCULE-6454857791 [0,1,0,0,0,1|2,0,0]=4 4653 B11R1.40 COC(=O)CC1CCOCC1 MCULE-8506370541 [0,1,0,0,0,1|2,0,0]=4 4654 B11R1.40 COC(=O)CC1CCSCC1 MCULE-2405303650 [0,1,0,0,0,1|2,0,0]=4 4655 B11R1.40 COC(=O)CC1CNCCN1 MCULE-3576929850 [0,1,0,0,0,1|1,0,0]=3 4656 B11R1.40 COC(=O)CC1CNCCN1 MCULE-4757525788 [0,1,0,0,0,1|1,0,0]=3 4657 B11R1.40 COC(=O)CC1CNCCN1 MCULE-7203538338 [0,1,0,0,0,1|1,0,0]=3 4658 B11R1.40 COC(=O)CC1CNCCO1 MCULE-1280217934 [0,1,0,0,0,1|1,0,0]=3 4659 B11R1.40 COC(=O)CC1CNCCO1 MCULE-5231998819 [0,1,0,0,0,1|1,0,0]=3 4660 B11R1.40 COC(=O)CC1COCCN1 MCULE-2640687961 [0,1,0,0,0,1|2,0,0]=4 4661 B11R1.40 COC(=O)CC1COCCN1 MCULE-4319243681 [0,1,0,0,0,1|2,0,0]=4 4662 B11R1.40 COC(=O)CC1CSCCN1 MCULE-7040890936 [0,1,0,0,0,1|2,0,0]=4 4663 B11R1.40 COC(=O)CC1CSCCN1 MCULE-8950718671 [0,1,0,0,0,1|2,0,0]=4 4664 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-3033016054 [0,1,0,0,0,1|0,0,0]=2 4665 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-3350930478 [0,1,0,0,0,1|0,0,0]=2 4666 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-8139225473 [0,1,0,0,0,1|0,0,0]=2 4667 B11R1.40 COC(=O)C[C@@H]1CCCNC1 MCULE-8627301252 [0,1,0,0,0,1|0,0,0]=2 4668 B11R1.40 COC(=O)C[C@@H]1CNCCN1 MCULE-1821824704 [0,1,0,0,0,1|1,0,0]=3 4669 B11R1.40 COC(=O)C[C@@H]1CNCCN1 MCULE-5290611199 [0,1,0,0,0,1|1,0,0]=3 4670 B11R1.40 COC(=O)C[C@@H]1CNCCO1 MCULE-3437799074 [0,1,0,0,0,1|1,0,0]=3 4671 B11R1.40 COC(=O)C[C@@H]1CNCCO1 MCULE-6671000639 [0,1,0,0,0,1|1,0,0]=3 4672 B11R1.40 COC(=O)C[C@@H]1CNCCO1 MCULE-7270283362 [0,1,0,0,0,1|1,0,0]=3 4673 B11R1.40 COC(=O)C[C@@H]1CNCCO1 MCULE-9537872850 [0,1,0,0,0,1|1,0,0]=3 4674 B11R1.40 COC(=O)C[C@@H]1COCCN1 MCULE-4086074684 [0,1,0,0,0,1|2,0,0]=4 4675 B11R1.40 COC(=O)C[C@@H]1COCCN1 MCULE-7136113319 [0,1,0,0,0,1|2,0,0]=4 4676 B11R1.40 COC(=O)C[C@@H]1COCCN1 MCULE-9153668055 [0,1,0,0,0,1|2,0,0]=4 4677 B11R1.40 COC(=O)C[C@H]1CCCCN1 MCULE-4319190168 [0,1,0,0,0,1|2,0,0]=4 4678 B11R1.40 COC(=O)C[C@H]1CCCCN1 MCULE-9265663838 [0,1,0,0,0,1|2,0,0]=4 4679 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-1720030033 [0,1,0,0,0,1|0,0,0]=2 4680 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-6508778923 [0,1,0,0,0,1|0,0,0]=2 4681 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-8131066241 [0,1,0,0,0,1|0,0,0]=2 4682 B11R1.40 COC(=O)C[C@H]1CCCNC1 MCULE-8434859537 [0,1,0,0,0,1|0,0,0]=2 4683 B11R1.40 COC(=O)C[C@H]1CNCCO1 MCULE-1415029428 [0,1,0,0,0,1|1,0,0]=3 4684 B11R1.40 COC(=O)C[C@H]1CNCCO1 MCULE-9109427537 [0,1,0,0,0,1|1,0,0]=3 4685 B11R1.40 COC(=O)C[C@H]1COCCN1 MCULE-1148901005 [0,1,0,0,0,1|2,0,0]=4 4686 B11R1.40 COC(=O)C[C@H]1COCCN1 MCULE-2621211628 [0,1,0,0,0,1|2,0,0]=4 4687 B11R1.40 COC(=O)C[C@H]1COCCN1 MCULE-6002409554 [0,1,0,0,0,1|2,0,0]=4 4688 B11R1.40 COC(=O)C[C@H]1COCCN1 MCULE-7064464399 [0,1,0,0,0,1|2,0,0]=4 4689 B11R1.40 COC(=O)NC1CCCCC1 MCULE-4935299070 [0,1,0,0,0,1|1,0,0]=3 4690 B11R1.40 COC(=O)NC1CCCNC1 MCULE-9996682353 [0,1,0,0,0,1|0,0,0]=2 4691 B11R1.40 COC(=O)NC1CCNCC1 MCULE-8108415339 [0,1,0,0,0,1|2,0,0]=4 4692 B11R1.40 COC(=O)NC1CCNCC1 MCULE-8590745688 [0,1,0,0,0,1|2,0,0]=4 4693 B11R1.40 CSC(=O)NC1CCCCC1 MCULE-8779554641 [0,1,0,0,0,1|1,1,0]=4 4694 B11R1.40 NCC(=O)CC1CCCCC1 MCULE-4965369909 [0,1,0,0,0,1|2,0,0]=4 4695 B11R1.40 NCC(=O)CC1CCCCC1 MCULE-5949367391 [0,1,0,0,0,1|2,0,0]=4 4696 B11R1.40 NCC(=O)NC1CCCCC1 MCULE-1668907798 [0,1,0,0,0,1|2,0,0]=4 4697 B11R1.40 NCC(=O)NC1CCCCC1 MCULE-4150861411 [0,1,0,0,0,1|2,0,0]=4 4698 B11R1.40 NCC(=O)OC1CCCCC1 MCULE-4537183431 [0,1,0,0,0,1|2,0,0]=4 4699 B11R1.40 NCC(=O)OC1CCCCC1 MCULE-8617505912 [0,1,0,0,0,1|2,0,0]=4 4700 B11R1.40 NNC(=O)CC1CCCCC1 MCULE-2424968160 [0,1,0,0,0,1|2,0,0]=4 4701 B11R1.40 NNC(=O)NC1CCCCC1 MCULE-2464651127 [0,1,0,0,0,1|2,0,0]=4 4702 B11R1.40 NNC(=O)NC1CCCCC1 MCULE-3060450923 [0,1,0,0,0,1|2,0,0]=4 4703 B11R1.40 O/N=C(\Cl)/CC1CCCCC1 MCULE-8496105670 [0,1,0,0,0,1|2,0,0]=4 4704 B11R1.40 O=C(CBr)NC1CCCCC1 MCULE-8628685131 [0,1,0,0,0,1|2,0,0]=4 4705 B11R1.40 O=C(CCl)NC1CCCCC1 MCULE-8446403285 [0,1,0,0,0,1|2,0,0]=4 4706 B11R1.40 O=C(CCl)OC1CCCCC1 MCULE-6110187916 [0,1,0,0,0,1|2,0,0]=4 4707 B11R1.40 O=C(CCl)OC1CCCNC1 MCULE-2595856950 [0,1,0,0,0,1|1,0,0]=3 4708 B11R1.40 O=C(CCl)OC1CCCNC1 MCULE-4278804817 [0,1,0,0,0,1|1,0,0]=3 4709 B11R1.40 O=C(CO)NC1CCCCC1 MCULE-5032379156 [0,1,0,0,0,1|1,0,0]=3 4710 B11R1.40 O=C(CS)OC1CCCCC1 MCULE-1157718305 [0,1,0,0,0,1|1,1,0]=4 4711 B11R1.86 CC(=O)NC1CCCCC1Br MCULE-4216605693 [0,1,0,0,0,1|2,0,0]=4 4712 B11R1.86 CC(=O)NC1CCCCC1Cl MCULE-7255544865 [0,1,0,0,0,1|2,0,0]=4 4713 B11R1.86 CC(=O)NC1CCCCC1N MCULE-7889648713 [0,1,0,0,0,1|2,0,0]=4 4714 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1Cl MCULE-5801087784 [0,1,0,0,0,1|2,0,0]=4 4715 B11R1.86 CC(=O)N[C@@H]1CCCC[C@H]1N MCULE-8588938231 [0,1,0,0,0,1|2,0,0]=4 4716 B11R1.86 CC(=O)N[C@H]1CCCC[C@H]1Cl MCULE-8672156380 [0,1,0,0,0,1|2,0,0]=4 4717 B11R1.86 CC(=O)OC1CCCCC1C MCULE-6335382849 [0,1,0,0,0,1|2,0,0]=4 4718 B11R1.86 CC1CCCCC1CC(=O)N MCULE-3919731608 [0,1,0,0,0,1|2,0,0]=4 4719 B11R1.86 CC1CCCCC1CC(=O)O MCULE-8512937446 [0,1,0,0,0,1|1,0,0]=3 4720 B11R1.86 CC1CCCCC1NC(=O)N MCULE-8304088077 [0,1,0,0,0,1|2,0,0]=4 4721 B11R1.86 CC1CCCCN1CC(=O)O MCULE-6978091572 [0,1,0,0,0,1|2,0,0]=4 4722 B11R1.86 CC1CCCCN1CC(=O)O MCULE-8958981548 [0,1,0,0,0,1|2,0,0]=4 4723 B11R1.86 CC1CCNCC1CC(=O)O MCULE-2573262395 [0,1,0,0,0,1|0,0,0]=2 4724 B11R1.86 CC1CCNCC1CC(=O)O MCULE-6926994477 [0,1,0,0,0,1|0,0,0]=2 4725 B11R1.86 CC1CNCCC1CC(=O)O MCULE-7212738787 [0,1,0,0,0,1|2,0,0]=4 4726 B11R1.86 CN1CCCCC1CC(=O)O MCULE-3316980419 [0,1,0,0,0,1|2,0,0]=4 4727 B11R1.86 CN1CCCCC1CC(=O)O MCULE-8860551772 [0,1,0,0,0,1|2,0,0]=4 4728 B11R1.86 NC1CCOCC1CC(=O)O MCULE-4690300395 [0,1,0,0,0,1|1,0,0]=3 4729 B11R1.86 O=C(Cl)OC1CCCCC1Cl MCULE-2250699778 [0,1,0,0,0,1|2,0,0]=4 4730 B11R1.86 O=C(Cl)O[C@@H]1CCCC[C@H]1F MCULE-4678998797 [0,1,0,0,0,1|2,0,0]=4 4731 B11R1.86 O=C(O)CC1CCCCC1=O MCULE-2872066455 [0,1,0,0,0,1|1,0,1]=4 4732 B11R1.86 O=C(O)CC1NCCNC1=O MCULE-1560589781 [0,1,0,0,0,1|1,0,1]=4 4733 B11R1.86 O=C(O)CC1NCCNC1=O MCULE-2096818355 [0,1,0,0,0,1|1,0,1]=4 4734 B11R1.86 O=C(O)CC1SCCNC1=O MCULE-5075946904 [0,1,0,0,0,1|1,0,1]=4 4735 B11R1.86 O=C(O)CN1CCCNC1=O MCULE-6462088384 [0,1,0,0,0,1|1,0,1]=4 4736 B11R1.86 O=C(O)C[C@@H]1CCCC[C@H]1O MCULE-4350134748 [0,1,0,0,0,1|1,0,0]=3 4737 B11R1.86 O=C(O)C[C@H]1CCCC[C@@H]1O MCULE-6436496571 [0,1,0,0,0,1|1,0,0]=3 4738 B11R1.157 CC1CCCC(C1)CC(=O)O MCULE-8177394227 [0,1,0,0,0,1|1,0,0]=3 4739 B11R1.157 CC1CCCN(C1)CC(=O)O MCULE-6740436113 [0,1,0,0,0,1|2,0,0]=4 4740 B11R1.157 CC1CCCN(C1)CC(=O)O MCULE-8756904184 [0,1,0,0,0,1|2,0,0]=4 4741 B11R1.157 CC1CCNC(C1)CC(=O)O MCULE-5716034877 [0,1,0,0,0,1|2,0,0]=4 4742 B11R1.157 CC1CNCC(C1)CC(=O)O MCULE-1750389348 [0,1,0,0,0,1|0,0,0]=2 4743 B11R1.157 CC1CNCC(C1)CC(=O)O MCULE-3483420567 [0,1,0,0,0,1|0,0,0]=2 4744 B11R1.157 CN1CCCC(C1)CC(=O)O MCULE-3307095078 [0,1,0,0,0,1|0,0,0]=2 4745 B11R1.157 CN1CCCC(C1)CC(=O)O MCULE-6317011723 [0,1,0,0,0,1|0,0,0]=2 4746 B11R1.157 NC1CCOC(C1)CC(=O)O MCULE-1365112311 [0,1,0,0,0,1|2,0,0]=4 4747 B11R1.157 NC1CCOC(C1)CC(=O)O MCULE-9509541900 [0,1,0,0,0,1|2,0,0]=4 4748 B11R1.157 O=C(O)CC1CCCC(=O)C1 MCULE-2070450942 [0,1,0,0,0,1|1,0,0]=3 4749 B11R1.157 O=C(O)CC1CCCC(=O)N1 MCULE-7470301343 [0,1,0,0,0,1|2,0,0]=4 4750 B11R1.157 O=C(O)CC1CCNC(=O)C1 MCULE-3498688720 [0,1,0,0,0,1|2,0,0]=4 4751 B11R1.157 O=C(O)CC1CCNC(=O)C1 MCULE-8598228573 [0,1,0,0,0,1|2,0,0]=4 4752 B11R1.157 O=C(O)CN1CCCC(C1)Br MCULE-2565385665 [0,1,0,0,0,1|2,0,0]=4 4753 B11R1.157 O=C(O)CN1CCCC(C1)Cl MCULE-9457969876 [0,1,0,0,0,1|2,0,0]=4 4754 B11R1.157 O=C(O)CN1CCCC(C1)I MCULE-1878633684 [0,1,0,0,0,1|2,0,0]=4 4755 B11R1.157 O=C(O)CN1CCCC(C1)O MCULE-4186047458 [0,1,0,0,0,1|2,0,0]=4 4756 B11R1.157 O=C(O)CN1CCC[C@@H](C1)O MCULE-3402932405 [0,1,0,0,0,1|2,0,0]=4 4757 B11R1.157 O=C(O)CN1CCC[C@H](C1)O MCULE-4870964189 [0,1,0,0,0,1|2,0,0]=4 4758 B11R1.509 CS(=O)(=O)CC1CCCNC1 MCULE-8228369708 [0,1,0,0,0,1|1,0,1]=4 4759 B11R1.509 CS(=O)(=O)CC1CCCNC1 MCULE-9585898111 [0,1,0,0,0,1|1,0,1]=4 4760 B11R1.509 CS(=O)(=O)NC1CCCNC1 MCULE-4946625548 [0,1,0,0,0,1|1,0,1]=4 4761 B11R1.509 CS(=O)(=O)NC1CCCNC1 MCULE-7493113339 [0,1,0,0,0,1|1,0,1]=4 4762 B11R1.509 CS(=O)(=O)N[C@@H]1CCCNC1 MCULE-3404473754 [0,1,0,0,0,1|1,0,1]=4 4763 B11R1.509 CS(=O)(=O)N[C@@H]1CCCNC1 MCULE-8695222742 [0,1,0,0,0,1|1,0,1]=4 4764 B11R1.509 CS(=O)(=O)N[C@H]1CCCNC1 MCULE-2842110476 [0,1,0,0,0,1|1,0,1]=4 4765 B11R1.509 CS(=O)(=O)N[C@H]1CCCNC1 MCULE-4672356026 [0,1,0,0,0,1|1,0,1]=4 4766 B11R1.509 CS(=O)(=O)N[C@H]1CCCNC1 MCULE-5169435912 [0,1,0,0,0,1|1,0,1]=4 4767 B11R1.509 CS(=O)(=O)N[C@H]1CCCNC1 MCULE-5986955230 [0,1,0,0,0,1|1,0,1]=4 4768 B11R1.509 NS(=O)(=O)CC1CCCNC1 MCULE-7949157720 [0,1,0,0,0,1|1,0,1]=4 4769 B11R1.509 NS(=O)(=O)CC1CCCNC1 MCULE-8761417825 [0,1,0,0,0,1|1,0,1]=4 4770 B11R1.509 O=S(=O)(F)CC1CCCNC1 MCULE-4593414421 [0,1,0,0,0,1|1,0,1]=4 4771 B11R1.509 O=S(=O)(F)CC1CCCNC1 MCULE-9016088183 [0,1,0,0,0,1|1,0,1]=4 4772 B11R1.509 O=S(=O)(O)CC1CCCCC1 MCULE-4699317759 [0,1,0,0,0,1|2,0,0]=4 4773 B11R1.509 O=S(=O)(O)CC1CCCNC1 MCULE-7277510962 [0,1,0,0,0,1|1,0,0]=3 4774 B11R1.509 O=S(=O)(O)NC1CCCCC1 MCULE-4630986316 [0,1,0,0,0,1|2,0,0]=4 4775 B11R1.509 O=S(=S)(O)NC1CCCCC1 MCULE-4425873836 [0,1,0,0,0,1|2,0,0]=4 4776 B11R1.509 O=S(=S)(O)NC1CCCCC1 MCULE-8464271623 [0,1,0,0,0,1|2,0,0]=4 4777 B11R1.928 CC(=O)NC1(CCCCC1)C MCULE-7381251920 [0,1,0,0,0,1|2,0,0]=4 4778 B11R1.928 CC1(CCCCC1)CC(=O)O MCULE-7882506747 [0,1,0,0,0,1|1,0,0]=3 4779 B11R1.928 CC1(CCNCC1)CC(=O)O MCULE-5814680905 [0,1,0,0,0,1|2,0,0]=4 4780 B11R1.928 CC1(CCNCC1)CC(=O)O MCULE-6867782906 [0,1,0,0,0,1|2,0,0]=4 4781 B11R1.928 CC1(CCOCC1)CC(=O)O MCULE-4326857569 [0,1,0,0,0,1|2,0,0]=4 4782 B11R1.928 NC(=O)CC1(CCCCC1)N MCULE-4039201792 [0,1,0,0,0,1|2,0,0]=4 4783 B11R1.928 NC(=O)CC1(CCCCC1)N MCULE-4397477502 [0,1,0,0,0,1|2,0,0]=4 4784 B11R1.928 NC1(CCCCC1)CC(=O)O MCULE-1663310557 [0,1,0,0,0,1|1,0,0]=3 4785 B11R1.928 NC1(CCCCC1)CC(=O)O MCULE-2879076377 [0,1,0,0,0,1|1,0,0]=3 4786 B11R1.928 NC1(CCCOC1)CC(=O)O MCULE-5652559264 [0,1,0,0,0,1|1,0,0]=3 4787 B11R1.928 NC1(CCCOC1)CC(=O)O MCULE-6139247914 [0,1,0,0,0,1|1,0,0]=3 4788 B11R1.928 NC1(CCOCC1)CC(=O)O MCULE-1850281708 [0,1,0,0,0,1|2,0,0]=4 4789 B11R1.928 NC1(CCOCC1)CC(=O)O MCULE-2706982629 [0,1,0,0,0,1|2,0,0]=4 4790 B11R1.928 NC1(CCSCC1)CC(=O)O MCULE-9758860021 [0,1,0,0,0,1|2,0,0]=4 4791 B11R1.928 O=C(O)CC1(CCCCC1)O MCULE-3422507323 [0,1,0,0,0,1|1,0,0]=3 4792 B11R1.928 O=C(O)CC1(CCCOC1)O MCULE-4776333020 [0,1,0,0,0,1|1,0,0]=3 4793 B11R1.928 O=C(O)CC1(CCNCC1)O MCULE-2683625220 [0,1,0,0,0,1|2,0,0]=4 4794 B11R1.928 O=C(O)CC1(CCNCC1)O MCULE-8049713319 [0,1,0,0,0,1|2,0,0]=4 4795 B11R1.928 O=C(O)CC1(CCOCC1)O MCULE-8349755612 [0,1,0,0,0,1|2,0,0]=4 4796 B11R1.143 CN1CCCCCC1C(=O)O MCULE-2653542021 [0,1,0,0,0,1|1,0,0]=3 4797 B11R1.143 CN1CCCCCC1C(=O)O MCULE-3417099605 [0,1,0,0,0,1|1,0,0]=3 4798 B11R1.143 NC1CCCCCC1C(=O)O MCULE-8944650297 [0,1,0,0,0,1|1,0,0]=3 4799 B11R1.143 NC1CCCCCC1C(=O)O MCULE-9787960494 [0,1,0,0,0,1|1,0,0]=3 4800 B11R1.497 CC(=O)C1CCCCC(=O)C1 MCULE-8090726810 [0,1,0,0,0,1|2,0,0]=4 4801 B11R1.497 CC(=O)N1CCNCC(C1)O MCULE-6634305760 [0,1,0,0,0,1|2,0,0]=4 4802 B11R1.497 CC(=O)N1CCNCC(C1)O MCULE-8301515073 [0,1,0,0,0,1|2,0,0]=4 4803 B11R1.497 CN1CCNCC(C1)C(=O)N MCULE-4062902352 [0,1,0,0,0,1|1,0,0]=3 4804 B11R1.497 NC1CCCCC(C1)C(=O)O MCULE-6764464855 [0,1,0,0,0,1|1,0,0]=3 4805 B11R1.497 O=C(O)C1CCCCC(C1)O MCULE-8775414897 [0,1,0,0,0,1|1,0,0]=3 4806 B11R1.497 O=C1CCCCC(C1)C(=O)O MCULE-7646723801 [0,1,0,0,0,1|1,0,0]=3 4807 B11R1.497 O=C1CCCCC(N1)C(=O)O MCULE-3462654668 [0,1,0,0,0,1|1,0,1]=4 4808 B11R1.497 O=C1CCSCC(N1)C(=O)O MCULE-1237852498 [0,1,0,0,0,1|1,0,1]=4 4809 B11R1.565 CN1CCCC(CC1)C(=O)O MCULE-2315942552 [0,1,0,0,0,1|0,0,0]=2 4810 B11R1.565 O=C1CCC(CCN1)C(=O)O MCULE-3530109531 [0,1,0,0,0,1|0,0,1]=3 4811 B11R1.565 O=C1CCC(CCO1)C(=O)O MCULE-4871150325 [0,1,0,0,0,1|1,0,1]=4 4812 B11R1.565 O=C1CCCC(CC1)C(=O)O MCULE-9475795957 [0,1,0,0,0,1|1,0,0]=3 4813 B11R1.737 CC1(CCCCCC1)C(=O)O MCULE-3584192725 [0,1,0,0,0,1|1,0,0]=3 4814 B11R1.737 NC(=O)C1(CCCCCC1)N MCULE-6163613760 [0,1,0,0,0,1|2,0,0]=4 4815 B11R1.737 NC(=O)C1(CCCCCC1)O MCULE-4135482773 [0,1,0,0,0,1|2,0,0]=4 4816 B11R1.737 NC1(CCCCCC1)C(=O)O MCULE-6498749639 [0,1,0,0,0,1|1,0,0]=3 4817 B11R1.737 NC1(CCCNCC1)C(=O)O MCULE-7153988486 [0,1,0,0,0,1|0,0,0]=2 4818 B11R1.737 O=C(O)C1(CCCCCC1)O MCULE-7470096721 [0,1,0,0,0,1|1,0,0]=3 4819 B11R1.852 CCC(=O)C1CCCCCC1 MCULE-7443621337 [0,1,0,0,0,1|2,0,0]=4 4820 B11R1.852 CCC(=O)N1CCCNCC1 MCULE-7409956244 [0,1,0,0,0,1|2,0,0]=4 4821 B11R1.852 CNC(=O)C1CCCCCC1 MCULE-8197745195 [0,1,0,0,0,1|2,0,0]=4 4822 B11R1.852 CNC(=O)C1CCCCCN1 MCULE-7805616586 [0,1,0,0,0,1|2,0,0]=4 4823 B11R1.852 CNC(=O)C1CNCCOC1 MCULE-5661503883 [0,1,0,0,0,1|1,0,0]=3 4824 B11R1.852 COC(=O)C1CCC=CCC1 MCULE-3027704453 [0,1,0,0,0,1|1,0,1]=4 4825 B11R1.852 COC(=O)C1CCCCCC1 MCULE-8003000735 [0,1,0,0,0,1|1,0,0]=3 4826 B11R1.852 COC(=O)C1CCCCCN1 MCULE-8548406183 [0,1,0,0,0,1|1,0,0]=3 4827 B11R1.852 COC(=O)C1CCCCCN1 MCULE-9755218906 [0,1,0,0,0,1|1,0,0]=3 4828 B11R1.852 COC(=O)C1CCCCNC1 MCULE-5033307999 [0,1,0,0,0,1|0,0,0]=2 4829 B11R1.852 COC(=O)C1CCCCNC1 MCULE-5999850816 [0,1,0,0,0,1|0,0,0]=2 4830 B11R1.852 COC(=O)C1CCCNCC1 MCULE-3407559638 [0,1,0,0,0,1|0,0,0]=2 4831 B11R1.852 COC(=O)C1CCCNCC1 MCULE-7978075592 [0,1,0,0,0,1|0,0,0]=2 4832 B11R1.852 COC(=O)C1CNCCCN1 MCULE-4382038267 [0,1,0,0,0,1|0,0,0]=2 4833 B11R1.852 COC(=O)C1CNCCCO1 MCULE-5602819799 [0,1,0,0,0,1|0,0,0]=2 4834 B11R1.852 COC(=O)C1CNCCCO1 MCULE-9238281261 [0,1,0,0,0,1|0,0,0]=2 4835 B11R1.852 COC(=O)C1CNCCOC1 MCULE-3087165562 [0,1,0,0,0,1|0,0,0]=2 4836 B11R1.852 COC(=O)C1CNCCOC1 MCULE-3586722287 [0,1,0,0,0,1|0,0,0]=2 4837 B11R1.852 COC(=O)C1CNCCSC1 MCULE-9024750063 [0,1,0,0,0,1|0,0,0]=2 4838 B11R1.852 COC(=O)N1CCCNCC1 MCULE-2036464472 [0,1,0,0,0,1|1,0,0]=3 4839 B11R1.852 COC(=O)N1CCCNCC1 MCULE-5917538833 [0,1,0,0,0,1|1,0,0]=3 4840 B11R1.852 COC(=O)[C@@H]1CCCCCN1 MCULE-2832726026 [0,1,0,0,0,1|1,0,0]=3 4841 B11R1.852 COC(=O)[C@@H]1CCCCCN1 MCULE-6917033588 [0,1,0,0,0,1|1,0,0]=3 4842 B11R1.852 COC(=O)[C@H]1CCCCCN1 MCULE-1594353042 [0,1,0,0,0,1|1,0,0]=3 4843 B11R1.852 COC(=O)[C@H]1CCCCCN1 MCULE-7957773860 [0,1,0,0,0,1|1,0,0]=3 4844 B11R1.852 O=C(CBr)C1CCCCCC1 MCULE-8804572153 [0,1,0,0,0,1|2,0,0]=4 4845 B11R1.852 O=C(CCl)C1CCCCCC1 MCULE-4633849063 [0,1,0,0,0,1|2,0,0]=4 4846 B11R1.852 O=C(CO)N1CCCCCC1 MCULE-3681107148 [0,1,0,0,0,1|2,0,0]=4 4847 B11R1.1121 CS(=O)(=O)C1CCCCNC1 MCULE-4286349388 [0,1,0,0,0,1|1,0,1]=4 4848 B11R1.1121 CS(=O)(=O)C1CCCCNC1 MCULE-8176146398 [0,1,0,0,0,1|1,0,1]=4 4849 B11R1.1121 CS(=O)(=O)C1CCCNCC1 MCULE-1498973203 [0,1,0,0,0,1|1,0,1]=4 4850 B11R1.1121 CS(=O)(=O)C1CCCNCC1 MCULE-7361142313 [0,1,0,0,0,1|1,0,1]=4 4851 B11R1.1121 NS(=O)(=O)C1CCCNCC1 MCULE-2893468978 [0,1,0,0,0,1|1,0,1]=4 4852 B11R1.1121 NS(=O)(=O)C1CCCNCC1 MCULE-8495460152 [0,1,0,0,0,1|1,0,1]=4 4853 B11R1.3 CCC1CCC(CC1)C(=O)O MCULE-3132418894 [0,2,0,0,0,0|1,0,0]=3 4854 B11R1.3 CCN1CCC(CC1)C(=O)O MCULE-1135533995 [0,2,0,0,0,0|2,0,0]=4 4855 B11R1.3 CCN1CCC(CC1)C(=O)O MCULE-1740909675 [0,2,0,0,0,0|2,0,0]=4 4856 B11R1.3 CC[C@H]1CC[C@@H](CC1)C(=O)O MCULE-6485034715 [0,2,0,0,0,0|1,0,0]=3 4857 B11R1.3 CNC1CCC(CC1)C(=O)O MCULE-4991563635 [0,2,0,0,0,0|1,0,0]=3 4858 B11R1.3 CNC1CCC(CC1)C(=O)O MCULE-7459674895 [0,2,0,0,0,0|1,0,0]=3 4859 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)N MCULE-2859430741 [0,2,0,0,0,0|2,0,0]=4 4860 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)N MCULE-9942994944 [0,2,0,0,0,0|2,0,0]=4 4861 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)O MCULE-2685872520 [0,2,0,0,0,0|1,0,0]=3 4862 B11R1.3 CN[C@H]1CC[C@@H](CC1)C(=O)O MCULE-8829935799 [0,2,0,0,0,0|1,0,0]=3 4863 B11R1.3 CN[C@H]1CC[C@H](CC1)C(=O)O MCULE-6088017598 [0,2,0,0,0,0|1,0,0]=3 4864 B11R1.3 CN[C@H]1CC[C@H](CC1)C(=O)O MCULE-7349966563 [0,2,0,0,0,0|1,0,0]=3 4865 B11R1.3 COC1CCC(CC1)C(=O)Cl MCULE-2869287615 [0,2,0,0,0,0|2,0,0]=4 4866 B11R1.3 COC1CCC(CC1)C(=O)O MCULE-7855539599 [0,2,0,0,0,0|1,0,0]=3 4867 B11R1.3 CON1CCC(CC1)C(=O)O MCULE-3896995710 [0,2,0,0,0,0|2,0,0]=4 4868 B11R1.3 CON1CCC(CC1)C(=O)O MCULE-6764383714 [0,2,0,0,0,0|2,0,0]=4 4869 B11R1.3 CO[C@H]1CC[C@H](CC1)C(=O)O MCULE-8120957519 [0,2,0,0,0,0|1,0,0]=3 4870 B11R1.3 N#CC1CCC(CC1)C(=O)O MCULE-8347063154 [0,2,0,0,0,0|1,0,0]=3 4871 B11R1.3 N#CN1CCC(CC1)C(=O)O MCULE-9838981821 [0,2,0,0,0,0|2,0,0]=4 4872 B11R1.3 N#C[C@H]1CC[C@@H](CC1)C(=O)O MCULE-3703985963 [0,2,0,0,0,0|1,0,0]=3 4873 B11R1.3 NCC1CCC(CC1)C(=O)Cl MCULE-6250880472 [0,2,0,0,0,0|2,0,0]=4 4874 B11R1.3 NCC1CCC(CC1)C(=O)N MCULE-3375105672 [0,2,0,0,0,0|2,0,0]=4 4875 B11R1.3 NCC1CCC(CC1)C(=O)N MCULE-8923425198 [0,2,0,0,0,0|2,0,0]=4 4876 B11R1.3 NCC1CCC(CC1)C(=O)O MCULE-6116475175 [0,2,0,0,0,0|1,0,0]=3 4877 B11R1.3 NC[C@H]1CC[C@@H](CC1)C(=O)O MCULE-6087008336 [0,2,0,0,0,0|1,0,0]=3 4878 B11R1.3 NC[C@H]1CC[C@H](CC1)C(=O)O MCULE-1914632389 [0,2,0,0,0,0|1,0,0]=3 4879 B11R1.3 NC[C@H]1CC[C@H](CC1)C(=O)O MCULE-6012248882 [0,2,0,0,0,0|1,0,0]=3 4880 B11R1.3 O=C(O)C1CCC(CC1)CBr MCULE-1483354720 [0,2,0,0,0,0|1,0,0]=3 4881 B11R1.3 O=C(O)C1CCC(CC1)CO MCULE-2678326595 [0,2,0,0,0,0|1,0,0]=3 4882 B11R1.3 O=C(O)[C@H]1CC[C@@H](CC1)CO MCULE-5678408450 [0,2,0,0,0,0|1,0,0]=3 4883 B11R1.3 O=C(O)[C@H]1CC[C@H](CC1)CO MCULE-8982391334 [0,2,0,0,0,0|1,0,0]=3 4884 B11R1.3 O=CN1CCC(CC1)C(=O)O MCULE-3355259649 [0,2,0,0,0,0|2,0,0]=4 4885 B11R1.3 [C@@H]1(CC[C@@H](CC1)C(=O)O)OC MCULE-7032796402 [0,2,0,0,0,0|1,0,0]=3 4886 B11R1.21 CC1=C(CC(CC1)C(=O)O)C MCULE-6601751883 [0,2,0,0,0,0|1,0,1]=4 4887 B11R1.21 CC1CC(CCC1=O)C(=O)O MCULE-1918471657 [0,2,0,0,0,0|1,0,1]=4 4888 B11R1.21 CC1CCC(CC1C)C(=O)O MCULE-5819111297 [0,2,0,0,0,0|1,0,0]=3 4889 B11R1.21 CC1CCC(CC1N)C(=O)O MCULE-3503061214 [0,2,0,0,0,0|1,0,0]=3 4890 B11R1.21 CN1CC(CCC1=O)C(=O)O MCULE-4009790849 [0,2,0,0,0,0|0,0,1]=3 4891 B11R1.21 CN1CC(NCC1=O)C(=O)O MCULE-1476207345 [0,2,0,0,0,0|1,0,1]=4 4892 B11R1.21 CN1CC(NCC1=O)C(=O)O MCULE-7602151554 [0,2,0,0,0,0|1,0,1]=4 4893 B11R1.21 CN1CCC(CC1=O)C(=O)O MCULE-7427834297 [0,2,0,0,0,0|2,0,0]=4 4894 B11R1.21 CN1CC[C@@H](CC1=O)C(=O)O MCULE-5366315291 [0,2,0,0,0,0|2,0,0]=4 4895 B11R1.21 CN1CC[C@@H](CC1=O)C(=O)O MCULE-9736243500 [0,2,0,0,0,0|2,0,0]=4 4896 B11R1.21 CN1C[C@@H](CCC1=O)C(=O)O MCULE-4384135288 [0,2,0,0,0,0|0,0,1]=3 4897 B11R1.21 CN1C[C@H](CCC1=O)C(=O)O MCULE-3136924816 [0,2,0,0,0,0|0,0,1]=3 4898 B11R1.21 CN1C[C@H](CCC1=O)C(=O)O MCULE-6449446697 [0,2,0,0,0,0|0,0,1]=3 4899 B11R1.21 N[C@H]1CC[C@H](C[C@@H]1O)C(=O)O MCULE-5165144051 [0,2,0,0,0,0|1,0,0]=3 4900 B11R1.21 N[C@H]1CC[C@H](C[C@@H]1O)C(=O)O MCULE-9735389419 [0,2,0,0,0,0|1,0,0]=3 4901 B11R1.21 N[C@H]1C[C@@H](CC[C@@H]1O)C(=O)O MCULE-8546749927 [0,2,0,0,0,0|1,0,0]=3 4902 B11R1.21 N[C@H]1C[C@@H](CC[C@@H]1O)C(=O)O MCULE-9445334860 [0,2,0,0,0,0|1,0,0]=3 4903 B11R1.22 CNC(=O)C1CCC(CC1)N MCULE-1679608263 [0,2,0,0,0,0|2,0,0]=4 4904 B11R1.22 CNC(=O)C1CCC(CC1)N MCULE-3984878852 [0,2,0,0,0,0|2,0,0]=4 4905 B11R1.22 CNC(=O)C1CCC(CC1)N MCULE-8266262668 [0,2,0,0,0,0|2,0,0]=4 4906 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)N MCULE-2911939177 [0,2,0,0,0,0|2,0,0]=4 4907 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)N MCULE-8592693332 [0,2,0,0,0,0|2,0,0]=4 4908 B11R1.22 CNC(=O)[C@H]1CC[C@@H](CC1)O MCULE-1562789029 [0,2,0,0,0,0|2,0,0]=4 4909 B11R1.22 CNC(=O)[C@H]1CC[C@H](CC1)N MCULE-6623398844 [0,2,0,0,0,0|2,0,0]=4 4910 B11R1.22 CNC(=O)[C@H]1CC[C@H](CC1)N MCULE-6794551639 [0,2,0,0,0,0|2,0,0]=4 4911 B11R1.22 COC(=O)C1CC=C(CC1)Br MCULE-7489389627 [0,2,0,0,0,0|1,0,1]=4 4912 B11R1.22 COC(=O)C1CC=C(CC1)C MCULE-7832981899 [0,2,0,0,0,0|1,0,1]=4 4913 B11R1.22 COC(=O)C1CCC(=NC1)N MCULE-7341627746 [0,2,0,0,0,0|0,0,2]=4 4914 B11R1.22 COC(=O)C1CCC(=NC1)N MCULE-7743330305 [0,2,0,0,0,0|0,0,2]=4 4915 B11R1.22 COC(=O)C1CCC(=O)CC1 MCULE-9783233720 [0,2,0,0,0,0|1,0,1]=4 4916 B11R1.22 COC(=O)C1CCC(=O)NC1 MCULE-4891190480 [0,2,0,0,0,0|0,0,1]=3 4917 B11R1.22 COC(=O)C1CCC(CC1)N MCULE-5482396714 [0,2,0,0,0,0|1,0,0]=3 4918 B11R1.22 COC(=O)C1CCC(CC1)N MCULE-6230504256 [0,2,0,0,0,0|1,0,0]=3 4919 B11R1.22 COC(=O)C1CCC(CC1)O MCULE-2490755485 [0,2,0,0,0,0|1,0,0]=3 4920 B11R1.22 COC(=O)C1CCC(CN1)O MCULE-9174504804 [0,2,0,0,0,0|2,0,0]=4 4921 B11R1.22 COC(=O)C1CCC(NC1)C MCULE-1103691698 [0,2,0,0,0,0|0,0,0]=2 4922 B11R1.22 COC(=O)C1CCC(NC1)C MCULE-4066328394 [0,2,0,0,0,0|0,0,0]=2 4923 B11R1.22 COC(=O)C1CCC(NC1)C MCULE-7905998970 [0,2,0,0,0,0|0,0,0]=2 4924 B11R1.22 COC(=O)C1CCN(CC1)C MCULE-1912799450 [0,2,0,0,0,0|2,0,0]=4 4925 B11R1.22 COC(=O)C1CNC(=O)CN1 MCULE-1207411341 [0,2,0,0,0,0|1,0,1]=4 4926 B11R1.22 COC(=O)C1CNC(=O)CN1 MCULE-3150881124 [0,2,0,0,0,0|1,0,1]=4 4927 B11R1.22 COC(=O)C1CNC(=O)CN1 MCULE-9361727201 [0,2,0,0,0,0|1,0,1]=4 4928 B11R1.22 COC(=O)C1CNC(CN1)C MCULE-2760554111 [0,2,0,0,0,0|1,0,0]=3 4929 B11R1.22 COC(=O)N1CCC(CC1)N MCULE-2040169911 [0,2,0,0,0,0|2,0,0]=4 4930 B11R1.22 COC(=O)N1CCC(CC1)N MCULE-9319946913 [0,2,0,0,0,0|2,0,0]=4 4931 B11R1.22 COC(=O)N1CCC(CC1)O MCULE-6751945083 [0,2,0,0,0,0|2,0,0]=4 4932 B11R1.22 COC(=O)[C@@H]1CCC(=O)NC1 MCULE-3019174474 [0,2,0,0,0,0|0,0,1]=3 4933 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CN1)O MCULE-1608906161 [0,2,0,0,0,0|2,0,0]=4 4934 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CN1)O MCULE-7535687002 [0,2,0,0,0,0|2,0,0]=4 4935 B11R1.22 COC(=O)[C@@H]1CC[C@@H](CN1)O MCULE-7886608473 [0,2,0,0,0,0|2,0,0]=4 4936 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-1999660404 [0,2,0,0,0,0|0,0,0]=2 4937 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-2455994251 [0,2,0,0,0,0|0,0,0]=2 4938 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-2976201730 [0,2,0,0,0,0|0,0,0]=2 4939 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-3782740676 [0,2,0,0,0,0|0,0,0]=2 4940 B11R1.22 COC(=O)[C@@H]1CC[C@@H](NC1)C MCULE-6464990394 [0,2,0,0,0,0|0,0,0]=2 4941 B11R1.22 COC(=O)[C@@H]1CC[C@H](CN1)O MCULE-1537696189 [0,2,0,0,0,0|2,0,0]=4 4942 B11R1.22 COC(=O)[C@@H]1CC[C@H](CN1)O MCULE-3334344307 [0,2,0,0,0,0|2,0,0]=4 4943 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-1654286744 [0,2,0,0,0,0|0,0,0]=2 4944 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-2389055337 [0,2,0,0,0,0|0,0,0]=2 4945 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-3268300078 [0,2,0,0,0,0|0,0,0]=2 4946 B11R1.22 COC(=O)[C@@H]1CC[C@H](NC1)C MCULE-5032774144 [0,2,0,0,0,0|0,0,0]=2 4947 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 MCULE-1663377634 [0,2,0,0,0,0|1,0,1]=4 4948 B11R1.22 COC(=O)[C@@H]1CNC(=O)CN1 MCULE-5733180811 [0,2,0,0,0,0|1,0,1]=4 4949 B11R1.22 COC(=O)[C@H]1CCC(=O)NC1 MCULE-7846998050 [0,2,0,0,0,0|0,0,1]=3 4950 B11R1.22 COC(=O)[C@H]1CCC(=O)NC1 MCULE-8720511544 [0,2,0,0,0,0|0,0,1]=3 4951 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)N MCULE-4855710087 [0,2,0,0,0,0|1,0,0]=3 4952 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)N MCULE-9225140469 [0,2,0,0,0,0|1,0,0]=3 4953 B11R1.22 COC(=O)[C@H]1CC[C@@H](CC1)O MCULE-8951158493 [0,2,0,0,0,0|1,0,0]=3 4954 B11R1.22 COC(=O)[C@H]1CC[C@@H](CN1)O MCULE-2977287737 [0,2,0,0,0,0|2,0,0]=4 4955 B11R1.22 COC(=O)[C@H]1CC[C@@H](CN1)O MCULE-3433906854 [0,2,0,0,0,0|2,0,0]=4 4956 B11R1.22 COC(=O)[C@H]1CC[C@@H](NC1)C MCULE-4324818722 [0,2,0,0,0,0|0,0,0]=2 4957 B11R1.22 COC(=O)[C@H]1CC[C@@H](NC1)C MCULE-5137006001 [0,2,0,0,0,0|0,0,0]=2 4958 B11R1.22 COC(=O)[C@H]1CC[C@@H](NC1)C MCULE-9584865102 [0,2,0,0,0,0|0,0,0]=2 4959 B11R1.22 COC(=O)[C@H]1CC[C@H](CC1)N MCULE-3165114207 [0,2,0,0,0,0|1,0,0]=3 4960 B11R1.22 COC(=O)[C@H]1CC[C@H](CC1)N MCULE-7537634861 [0,2,0,0,0,0|1,0,0]=3 4961 B11R1.22 COC(=O)[C@H]1CC[C@H](CC1)O MCULE-4794376608 [0,2,0,0,0,0|1,0,0]=3 4962 B11R1.22 COC(=O)[C@H]1CC[C@H](CN1)O MCULE-4862825259 [0,2,0,0,0,0|2,0,0]=4 4963 B11R1.22 COC(=O)[C@H]1CC[C@H](CN1)O MCULE-8270495818 [0,2,0,0,0,0|2,0,0]=4 4964 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-1064182684 [0,2,0,0,0,0|0,0,0]=2 4965 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-5686053466 [0,2,0,0,0,0|0,0,0]=2 4966 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-7329517559 [0,2,0,0,0,0|0,0,0]=2 4967 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-7669213048 [0,2,0,0,0,0|0,0,0]=2 4968 B11R1.22 COC(=O)[C@H]1CC[C@H](NC1)C MCULE-8006054967 [0,2,0,0,0,0|0,0,0]=2 4969 B11R1.22 COC(=O)[C@H]1CNC(=O)CN1 MCULE-1475020895 [0,2,0,0,0,0|1,0,1]=4 4970 B11R1.22 [C@H]1(CC[C@H](CN1)C(=O)OC)C MCULE-3786752577 [0,2,0,0,0,0|0,0,0]=2 4971 B11R1.166 CC1CC(=O)CCC1C(=O)O MCULE-7852085763 [0,2,0,0,0,0|1,0,1]=4 4972 B11R1.166 CC1CCC(C(C1)C)C(=O)O MCULE-4443353151 [0,2,0,0,0,0|1,0,0]=3 4973 B11R1.166 CC1CCC(C(N1)C)C(=O)N MCULE-3261318196 [0,2,0,0,0,0|1,0,0]=3 4974 B11R1.166 CC1CCC(C(N1)C)C(=O)N MCULE-3503260929 [0,2,0,0,0,0|1,0,0]=3 4975 B11R1.166 CC1CNC(C(O1)C)C(=O)O MCULE-8279243440 [0,2,0,0,0,0|2,0,0]=4 4976 B11R1.166 CC1CNC(C(O1)C)C(=O)O MCULE-9957606244 [0,2,0,0,0,0|2,0,0]=4 4977 B11R1.166 C[C@@H]1CC(=O)CC[C@H]1C(=O)O MCULE-2460783843 [0,2,0,0,0,0|1,0,1]=4 4978 B11R1.166 C[C@@H]1CC(=O)CC[C@H]1C(=O)O MCULE-7956491903 [0,2,0,0,0,0|1,0,1]=4 4979 B11R1.166 C[C@@H]1C[C@@H](CC[C@@H]1C(=O)O)N MCULE-1369859957 [0,2,0,0,0,0|1,0,0]=3 4980 B11R1.166 C[C@@H]1C[C@@H](CC[C@@H]1C(=O)O)N MCULE-8513246239 [0,2,0,0,0,0|1,0,0]=3 4981 B11R1.166 C[C@H]1CC(=O)CC[C@H]1C(=O)O MCULE-3967440664 [0,2,0,0,0,0|1,0,1]=4 4982 B11R1.166 C[C@H]1CC(=O)CC[C@H]1C(=O)O MCULE-5142454558 [0,2,0,0,0,0|1,0,1]=4 4983 B11R1.220 CC(=O)C1(CCC(CC1)C)C MCULE-1641456468 [0,2,0,0,0,0|2,0,0]=4 4984 B11R1.220 CC1(CCC(=O)CC1)C(=O)O MCULE-1572569153 [0,2,0,0,0,0|1,0,1]=4 4985 B11R1.220 CC1(CCC(=O)NC1)C(=O)O MCULE-2805915574 [0,2,0,0,0,0|0,0,1]=3 4986 B11R1.220 CC1(CCC(CC1)N)C(=O)N MCULE-9249091360 [0,2,0,0,0,0|2,0,0]=4 4987 B11R1.220 CC1(CCC(CC1)O)C(=O)O MCULE-4694168525 [0,2,0,0,0,0|1,0,0]=3 4988 B11R1.220 CC1=CCC(CC1)(C)C(=O)O MCULE-9625022025 [0,2,0,0,0,0|1,0,1]=4 4989 B11R1.220 CC1CCC(CC1)(C)C(=O)N MCULE-8954217069 [0,2,0,0,0,0|2,0,0]=4 4990 B11R1.220 CC1CCC(CC1)(C)C(=O)O MCULE-7822016719 [0,2,0,0,0,0|1,0,0]=3 4991 B11R1.220 CC1CCC(CC1)(F)C(=O)O MCULE-8829791353 [0,2,0,0,0,0|1,0,0]=3 4992 B11R1.220 CC1CCC(CC1)(N)C(=O)N MCULE-1630564728 [0,2,0,0,0,0|2,0,0]=4 4993 B11R1.220 CC1CCC(CC1)(N)C(=O)O MCULE-7735898604 [0,2,0,0,0,0|1,0,0]=3 4994 B11R1.220 CC1CCC(CC1)(O)C(=O)O MCULE-2392362320 [0,2,0,0,0,0|1,0,0]=3 4995 B11R1.220 CN1CCC(CC1)(C)C(=O)O MCULE-3834694510 [0,2,0,0,0,0|2,0,0]=4 4996 B11R1.220 CN1CCC(CC1)(C)C(=O)O MCULE-6310965473 [0,2,0,0,0,0|2,0,0]=4 4997 B11R1.220 CN1CCC(CC1)(F)C(=O)O MCULE-5733063609 [0,2,0,0,0,0|2,0,0]=4 4998 B11R1.220 CN1CCC(CC1)(F)C(=O)O MCULE-8739311714 [0,2,0,0,0,0|2,0,0]=4 4999 B11R1.220 CN1CCC(CC1)(N)C(=O)O MCULE-7077088205 [0,2,0,0,0,0|2,0,0]=4 5000 B11R1.220 CN1CCC(CC1)(N)C(=O)O MCULE-9740380672 [0,2,0,0,0,0|2,0,0]=4 5001 B11R1.220 CN1CCC(CC1)(O)C(=O)O MCULE-3745539292 [0,2,0,0,0,0|2,0,0]=4 5002 B11R1.220 CN1CCC(CC1)(O)C(=O)O MCULE-9976204914 [0,2,0,0,0,0|2,0,0]=4 5003 B11R1.220 C[C@@]1(CC[C@@H](CC1)N)C(=O)N MCULE-1121011171 [0,2,0,0,0,0|2,0,0]=4 5004 B11R1.220 C[C@@]1(CC[C@@H](CC1)O)C(=O)O MCULE-5793928535 [0,2,0,0,0,0|1,0,0]=3 5005 B11R1.220 NC(=O)C1(CCC(CC1)N)O MCULE-5207754653 [0,2,0,0,0,0|2,0,0]=4 5006 B11R1.220 NC1(CCC(=O)CC1)C(=O)O MCULE-6857901798 [0,2,0,0,0,0|1,0,1]=4 5007 B11R1.220 NC1CCC(CC1)(O)C(=O)O MCULE-8309786604 [0,2,0,0,0,0|1,0,0]=3 5008 B11R1.727 CC(=O)C1CCC(CC1)(F)F MCULE-6465926442 [0,2,0,0,0,0|2,0,0]=4 5009 B11R1.727 CC1(CCC(CC1)C(=O)O)C MCULE-4077940511 [0,2,0,0,0,0|1,0,0]=3 5010 B11R1.727 CC1(CCC(CC1)C(=O)O)O MCULE-4857156703 [0,2,0,0,0,0|1,0,0]=3 5011 B11R1.727 CC1(CCC(CO1)C(=O)O)C MCULE-6004318139 [0,2,0,0,0,0|1,0,0]=3 5012 B11R1.727 CC1(CCC(OC1)C(=O)O)C MCULE-4564560513 [0,2,0,0,0,0|2,0,0]=4 5013 B11R1.727 CC1(CNC(CO1)C(=O)O)C MCULE-4256075993 [0,2,0,0,0,0|2,0,0]=4 5014 B11R1.727 CC1(CNC(CO1)C(=O)O)C MCULE-7885479811 [0,2,0,0,0,0|2,0,0]=4 5015 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-4507731051 [0,2,0,0,0,0|2,0,0]=4 5016 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-6942026456 [0,2,0,0,0,0|2,0,0]=4 5017 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-8456032294 [0,2,0,0,0,0|2,0,0]=4 5018 B11R1.727 CC1(CN[C@@H](CO1)C(=O)O)C MCULE-9879183937 [0,2,0,0,0,0|2,0,0]=4 5019 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-1777900508 [0,2,0,0,0,0|2,0,0]=4 5020 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-3103501136 [0,2,0,0,0,0|2,0,0]=4 5021 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-3507812849 [0,2,0,0,0,0|2,0,0]=4 5022 B11R1.727 CC1(CN[C@H](CO1)C(=O)O)C MCULE-7408744740 [0,2,0,0,0,0|2,0,0]=4 5023 B11R1.727 CC1(COC(CN1)C(=O)O)C MCULE-4924802724 [0,2,0,0,0,0|1,0,0]=3 5024 B11R1.727 CC1(COC(CN1)C(=O)O)C MCULE-8615912536 [0,2,0,0,0,0|1,0,0]=3 5025 B11R1.727 CC1(COC(CO1)C(=O)O)C MCULE-2956860789 [0,2,0,0,0,0|2,0,0]=4 5026 B11R1.727 CC1(OCC(CO1)C(=O)O)C MCULE-4017939892 [0,2,0,0,0,0|2,0,0]=4 5027 B11R1.727 NC(=O)C1CCC(CC1)(F)F MCULE-5976787934 [0,2,0,0,0,0|2,0,0]=4 5028 B11R1.727 O=C(Cl)C1CCC(CC1)(F)F MCULE-8318348405 [0,2,0,0,0,0|2,0,0]=4 5029 B11R1.727 O=C(O)C1CCC(CC1)(F)F MCULE-1527222921 [0,2,0,0,0,0|1,0,0]=3 5030 B11R1.727 O=C(O)C1CCC(CN1)(F)F MCULE-5193548537 [0,2,0,0,0,0|2,0,0]=4 5031 B11R1.727 O=C(O)C1CCC(CO1)(F)F MCULE-7251941830 [0,2,0,0,0,0|2,0,0]=4 5032 B11R1.727 O=C(O)C1CCS(=O)(=O)CC1 MCULE-1947181749 [0,2,0,0,0,0|2,0,0]=4 5033 B11R1.727 O=C(O)[C@@H]1CCC(CN1)(F)F MCULE-7313789029 [0,2,0,0,0,0|2,0,0]=4 5034 B11R1.7 CNS(=O)(=O)C1CCCNC1 MCULE-3696937084 [0,2,0,0,0,0|1,0,1]=4 5035 B11R1.7 CNS(=O)(=O)C1CCCNC1 MCULE-5683897352 [0,2,0,0,0,0|1,0,1]=4 5036 B11R1.12 COC(C=O)C1CCCCC1 MCULE-4823823476 [0,2,0,0,0,0|1,0,1]=4 5037 B11R1.16 C1(CCCNC1)C(=O)OCC MCULE-7218455020 [0,2,0,0,0,0|0,0,0]=2 5038 B11R1.16 CCCC(=O)C1CCCCC1 MCULE-1634042258 [0,2,0,0,0,0|2,0,0]=4 5039 B11R1.16 CCNC(=O)C1CCCCC1 MCULE-9090071277 [0,2,0,0,0,0|2,0,0]=4 5040 B11R1.16 CCNC(=O)C1CCCNC1 MCULE-7944955194 [0,2,0,0,0,0|1,0,0]=3 5041 B11R1.16 CCNC(=O)C1CCCNC1 MCULE-9403348329 [0,2,0,0,0,0|1,0,0]=3 5042 B11R1.16 CCNC(=O)[C@H]1CCCNC1 MCULE-8719808862 [0,2,0,0,0,0|1,0,0]=3 5043 B11R1.16 CCOC(=O)C1=CCCNC1 MCULE-2494881503 [0,2,0,0,0,0|0,0,2]=4 5044 B11R1.16 CCOC(=O)C1=CCCNC1 MCULE-9977440197 [0,2,0,0,0,0|0,0,2]=4 5045 B11R1.16 CCOC(=O)C1=CNCCC1 MCULE-9071812580 [0,2,0,0,0,0|0,0,2]=4 5046 B11R1.16 CCOC(=O)C1CC=CCC1 MCULE-1210480263 [0,2,0,0,0,0|1,0,1]=4 5047 B11R1.16 CCOC(=O)C1CCCCC1 MCULE-9489706932 [0,2,0,0,0,0|1,0,0]=3 5048 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-3387848530 [0,2,0,0,0,0|2,0,0]=4 5049 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-6852631244 [0,2,0,0,0,0|2,0,0]=4 5050 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-7008895744 [0,2,0,0,0,0|2,0,0]=4 5051 B11R1.16 CCOC(=O)C1CCCCN1 MCULE-8548542082 [0,2,0,0,0,0|2,0,0]=4 5052 B11R1.16 CCOC(=O)C1CCCCO1 MCULE-6947775878 [0,2,0,0,0,0|2,0,0]=4 5053 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-3675023359 [0,2,0,0,0,0|0,0,0]=2 5054 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-4746135984 [0,2,0,0,0,0|0,0,0]=2 5055 B11R1.16 CCOC(=O)C1CCCNC1 MCULE-8856518925 [0,2,0,0,0,0|0,0,0]=2 5056 B11R1.16 CCOC(=O)C1CCCOC1 MCULE-7996513426 [0,2,0,0,0,0|1,0,0]=3 5057 B11R1.16 CCOC(=O)C1CCNCC1 MCULE-1027841713 [0,2,0,0,0,0|2,0,0]=4 5058 B11R1.16 CCOC(=O)C1CCNCC1 MCULE-4502754234 [0,2,0,0,0,0|2,0,0]=4 5059 B11R1.16 CCOC(=O)C1CCOCC1 MCULE-6838508341 [0,2,0,0,0,0|2,0,0]=4 5060 B11R1.16 CCOC(=O)C1CNCCN1 MCULE-2206886293 [0,2,0,0,0,0|1,0,0]=3 5061 B11R1.16 CCOC(=O)C1CNCCN1 MCULE-6219416292 [0,2,0,0,0,0|1,0,0]=3 5062 B11R1.16 CCOC(=O)C1CNCCO1 MCULE-3813416121 [0,2,0,0,0,0|1,0,0]=3 5063 B11R1.16 CCOC(=O)C1CNCCO1 MCULE-4556889516 [0,2,0,0,0,0|1,0,0]=3 5064 B11R1.16 CCOC(=O)C1CNCCO1 MCULE-7807962708 [0,2,0,0,0,0|1,0,0]=3 5065 B11R1.16 CCOC(=O)C1CNCCS1 MCULE-5596720547 [0,2,0,0,0,0|1,0,0]=3 5066 B11R1.16 CCOC(=O)C1CNCCS1 MCULE-7516167282 [0,2,0,0,0,0|1,0,0]=3 5067 B11R1.16 CCOC(=O)C1COCCN1 MCULE-4544792215 [0,2,0,0,0,0|2,0,0]=4 5068 B11R1.16 CCOC(=O)C1COCCN1 MCULE-5098841572 [0,2,0,0,0,0|2,0,0]=4 5069 B11R1.16 CCOC(=O)C1COCCN1 MCULE-7977008329 [0,2,0,0,0,0|2,0,0]=4 5070 B11R1.16 CCOC(=O)C1COCCN1 MCULE-8786998804 [0,2,0,0,0,0|2,0,0]=4 5071 B11R1.16 CCOC(=O)C1CSCCN1 MCULE-5092594438 [0,2,0,0,0,0|2,0,0]=4 5072 B11R1.16 CCOC(=O)C1CSCCN1 MCULE-5956138488 [0,2,0,0,0,0|2,0,0]=4 5073 B11R1.16 CCOC(=O)N1CCCCC1 MCULE-9100997547 [0,2,0,0,0,0|2,0,0]=4 5074 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-1748361632 [0,2,0,0,0,0|2,0,0]=4 5075 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-2693297322 [0,2,0,0,0,0|2,0,0]=4 5076 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-5302379375 [0,2,0,0,0,0|2,0,0]=4 5077 B11R1.16 CCOC(=O)[C@@H]1CCCCN1 MCULE-6361807016 [0,2,0,0,0,0|2,0,0]=4 5078 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-1359008002 [0,2,0,0,0,0|0,0,0]=2 5079 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-3017848023 [0,2,0,0,0,0|0,0,0]=2 5080 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-3626074988 [0,2,0,0,0,0|0,0,0]=2 5081 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-4968733918 [0,2,0,0,0,0|0,0,0]=2 5082 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-8465407593 [0,2,0,0,0,0|0,0,0]=2 5083 B11R1.16 CCOC(=O)[C@@H]1CCCNC1 MCULE-9622641716 [0,2,0,0,0,0|0,0,0]=2 5084 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-3192032854 [0,2,0,0,0,0|2,0,0]=4 5085 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-3475970595 [0,2,0,0,0,0|2,0,0]=4 5086 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-6499252353 [0,2,0,0,0,0|2,0,0]=4 5087 B11R1.16 CCOC(=O)[C@@H]1COCCN1 MCULE-9799550356 [0,2,0,0,0,0|2,0,0]=4 5088 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-1831173115 [0,2,0,0,0,0|2,0,0]=4 5089 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-3506778792 [0,2,0,0,0,0|2,0,0]=4 5090 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-4098494223 [0,2,0,0,0,0|2,0,0]=4 5091 B11R1.16 CCOC(=O)[C@H]1CCCCN1 MCULE-7328799091 [0,2,0,0,0,0|2,0,0]=4 5092 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-2736748797 [0,2,0,0,0,0|0,0,0]=2 5093 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-3698900770 [0,2,0,0,0,0|0,0,0]=2 5094 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-6641118890 [0,2,0,0,0,0|0,0,0]=2 5095 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-7157160072 [0,2,0,0,0,0|0,0,0]=2 5096 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-7599426784 [0,2,0,0,0,0|0,0,0]=2 5097 B11R1.16 CCOC(=O)[C@H]1CCCNC1 MCULE-9165782492 [0,2,0,0,0,0|0,0,0]=2 5098 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-2826637726 [0,2,0,0,0,0|1,0,0]=3 5099 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-5977561991 [0,2,0,0,0,0|1,0,0]=3 5100 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-9147321196 [0,2,0,0,0,0|1,0,0]=3 5101 B11R1.16 CCOC(=O)[C@H]1CNCCO1 MCULE-9852355835 [0,2,0,0,0,0|1,0,0]=3 5102 B11R1.16 CN(CCO)C1CCCNC1 MCULE-1371527321 [0,2,0,0,0,0|2,0,0]=4 5103 B11R1.16 CN(CCO)C1CCCNC1 MCULE-9665637930 [0,2,0,0,0,0|2,0,0]=4 5104 B11R1.16 COCC(=O)C1CCCOC1 MCULE-3014326577 [0,2,0,0,0,0|1,0,0]=3 5105 B11R1.16 COCC(=O)C1CCOCC1 MCULE-5676426431 [0,2,0,0,0,0|2,0,0]=4 5106 B11R1.16 CONC(=O)C1CCNCC1 MCULE-1633790449 [0,2,0,0,0,0|2,0,0]=4 5107 B11R1.16 CONC(=O)C1CCNCC1 MCULE-3861247612 [0,2,0,0,0,0|2,0,0]=4 5108 B11R1.16 N#CCC(=O)C1CCCCC1 MCULE-1084119855 [0,2,0,0,0,0|2,0,0]=4 5109 B11R1.16 N#CCC(=O)C1CCCOC1 MCULE-2943703497 [0,2,0,0,0,0|2,0,0]=4 5110 B11R1.16 N1CCCC(C1)C(=O)OCC MCULE-7955165183 [0,2,0,0,0,0|0,0,0]=2 5111 B11R1.16 NOCC(=O)N1CCCCC1 MCULE-5229378435 [0,2,0,0,0,0|2,0,0]=4 5112 B11R1.16 NOCC(=O)N1CCCCC1 MCULE-9588241418 [0,2,0,0,0,0|2,0,0]=4 5113 B11R1.16 O=C(CCO)C1CCCCC1 MCULE-2427892471 [0,2,0,0,0,0|1,0,0]=3 5114 B11R1.16 O=C(N=C=S)C1CCCCC1 MCULE-3947730285 [0,2,0,0,0,0|1,1,0]=4 5115 B11R1.16 O=C(OCCl)C1CCCCC1 MCULE-2780074453 [0,2,0,0,0,0|1,0,0]=3 5116 B11R1.16 O=CCC(O)C1CCCCC1 MCULE-1523208411 [0,2,0,0,0,0|1,0,1]=4 5117 B11R1.23 CC1CCCN(C1)C(=O)CO MCULE-4805076313 [0,2,0,0,0,0|2,0,0]=4 5118 B11R1.23 CN1CCCC(C1)C(=O)NN MCULE-3371482980 [0,2,0,0,0,0|1,0,0]=3 5119 B11R1.23 CN1CCOC(C1)/C(=N/O)/N MCULE-8939867905 [0,2,0,0,0,0|2,0,0]=4 5120 B11R1.23 CNC(=O)C1CN(CCN1)C MCULE-6626158125 [0,2,0,0,0,0|2,0,0]=4 5121 B11R1.23 CNC(=O)C1CN(CCN1)C MCULE-8533047802 [0,2,0,0,0,0|2,0,0]=4 5122 B11R1.23 CNC(=O)C1CNCC(C1)C MCULE-9576431849 [0,2,0,0,0,0|1,0,0]=3 5123 B11R1.23 CNC(=O)[C@H]1CCC[C@H](C1)N MCULE-5164231080 [0,2,0,0,0,0|2,0,0]=4 5124 B11R1.23 COC(=O)C1=CCCN(C1)C MCULE-3548065583 [0,2,0,0,0,0|0,0,2]=4 5125 B11R1.23 COC(=O)C1=CCCN(C1)C MCULE-7085698770 [0,2,0,0,0,0|0,0,2]=4 5126 B11R1.23 COC(=O)C1=CCCN(C1)C MCULE-7834041957 [0,2,0,0,0,0|0,0,2]=4 5127 B11R1.23 COC(=O)C1CC(=O)CCN1 MCULE-2957789839 [0,2,0,0,0,0|2,0,0]=4 5128 B11R1.23 COC(=O)C1CC(=O)CCN1 MCULE-7628754673 [0,2,0,0,0,0|2,0,0]=4 5129 B11R1.23 COC(=O)C1CC(CCN1)C MCULE-1457564964 [0,2,0,0,0,0|2,0,0]=4 5130 B11R1.23 COC(=O)C1CC(CCN1)C MCULE-2332457766 [0,2,0,0,0,0|2,0,0]=4 5131 B11R1.23 COC(=O)C1CC(CCN1)O MCULE-1497004684 [0,2,0,0,0,0|2,0,0]=4 5132 B11R1.23 COC(=O)C1CC(CCN1)O MCULE-7170666495 [0,2,0,0,0,0|2,0,0]=4 5133 B11R1.23 COC(=O)C1CC=CC(C1)O MCULE-2728065324 [0,2,0,0,0,0|1,0,1]=4 5134 B11R1.23 COC(=O)C1CCCC(=O)C1 MCULE-4326233018 [0,2,0,0,0,0|1,0,0]=3 5135 B11R1.23 COC(=O)C1CCCC(=O)N1 MCULE-8690572370 [0,2,0,0,0,0|2,0,0]=4 5136 B11R1.23 COC(=O)C1CCCC(C1)C MCULE-4272190031 [0,2,0,0,0,0|1,0,0]=3 5137 B11R1.23 COC(=O)C1CCCC(C1)N MCULE-2634773813 [0,2,0,0,0,0|1,0,0]=3 5138 B11R1.23 COC(=O)C1CCCC(C1)N MCULE-5676579524 [0,2,0,0,0,0|1,0,0]=3 5139 B11R1.23 COC(=O)C1CCCC(C1)O MCULE-7531952837 [0,2,0,0,0,0|1,0,0]=3 5140 B11R1.23 COC(=O)C1CCCC(N1)C MCULE-7945233826 [0,2,0,0,0,0|2,0,0]=4 5141 B11R1.23 COC(=O)C1CCCN(C1)C MCULE-9564999871 [0,2,0,0,0,0|0,0,0]=2 5142 B11R1.23 COC(=O)C1CCNC(=O)C1 MCULE-4250140902 [0,2,0,0,0,0|2,0,0]=4 5143 B11R1.23 COC(=O)C1CCNC(C1)C MCULE-1767850198 [0,2,0,0,0,0|2,0,0]=4 5144 B11R1.23 COC(=O)C1CCNC(C1)C MCULE-4654958614 [0,2,0,0,0,0|2,0,0]=4 5145 B11R1.23 COC(=O)C1CN(CCN1)C MCULE-4547246021 [0,2,0,0,0,0|1,0,0]=3 5146 B11R1.23 COC(=O)C1CN(CCN1)C MCULE-8755175940 [0,2,0,0,0,0|1,0,0]=3 5147 B11R1.23 COC(=O)C1CN(CCO1)C MCULE-2961200374 [0,2,0,0,0,0|1,0,0]=3 5148 B11R1.23 COC(=O)C1CNCC(=O)N1 MCULE-4044240233 [0,2,0,0,0,0|1,0,1]=4 5149 B11R1.23 COC(=O)C1CNCC(C1)C MCULE-6792476382 [0,2,0,0,0,0|0,0,0]=2 5150 B11R1.23 COC(=O)C1CNCC(C1)C MCULE-7677037243 [0,2,0,0,0,0|0,0,0]=2 5151 B11R1.23 COC(=O)C1CNCC(C1)F MCULE-1891281041 [0,2,0,0,0,0|0,0,0]=2 5152 B11R1.23 COC(=O)C1CNCC(C1)O MCULE-8962874525 [0,2,0,0,0,0|0,0,0]=2 5153 B11R1.23 COC(=O)C1CNCC(C1)O MCULE-9903585063 [0,2,0,0,0,0|0,0,0]=2 5154 B11R1.23 COC(=O)C1CNNC(=O)C1 MCULE-8947267618 [0,2,0,0,0,0|1,0,1]=4 5155 B11R1.23 COC(=O)C1COCC(=O)C1 MCULE-9367979634 [0,2,0,0,0,0|1,0,1]=4 5156 B11R1.23 COC(=O)C1COCC(C1)O MCULE-1450615868 [0,2,0,0,0,0|1,0,0]=3 5157 B11R1.23 COC(=O)C1COCC(N1)C MCULE-5531646699 [0,2,0,0,0,0|2,0,0]=4 5158 B11R1.23 COC(=O)N1CCCC(=O)C1 MCULE-1429565297 [0,2,0,0,0,0|2,0,0]=4 5159 B11R1.23 COC(=O)N1CCCC(C1)N MCULE-9325390324 [0,2,0,0,0,0|2,0,0]=4 5160 B11R1.23 COC(=O)N1CCCC(C1)O MCULE-2922700960 [0,2,0,0,0,0|2,0,0]=4 5161 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 MCULE-2526553506 [0,2,0,0,0,0|2,0,0]=4 5162 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 MCULE-6095368090 [0,2,0,0,0,0|2,0,0]=4 5163 B11R1.23 COC(=O)[C@@H]1CCCC(=O)C1 MCULE-6640888029 [0,2,0,0,0,0|1,0,0]=3 5164 B11R1.23 COC(=O)[C@@H]1CCCN(C1)C MCULE-1258635616 [0,2,0,0,0,0|0,0,0]=2 5165 B11R1.23 COC(=O)[C@@H]1CCCN(C1)C MCULE-6613258400 [0,2,0,0,0,0|0,0,0]=2 5166 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)C MCULE-1409445255 [0,2,0,0,0,0|1,0,0]=3 5167 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-1032335921 [0,2,0,0,0,0|1,0,0]=3 5168 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-4186486646 [0,2,0,0,0,0|1,0,0]=3 5169 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-4922382608 [0,2,0,0,0,0|1,0,0]=3 5170 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)N MCULE-6734699447 [0,2,0,0,0,0|1,0,0]=3 5171 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)O MCULE-2826570915 [0,2,0,0,0,0|1,0,0]=3 5172 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](C1)O MCULE-5275681878 [0,2,0,0,0,0|1,0,0]=3 5173 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-2795807911 [0,2,0,0,0,0|1,0,0]=3 5174 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-4127929384 [0,2,0,0,0,0|1,0,0]=3 5175 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-4717498053 [0,2,0,0,0,0|1,0,0]=3 5176 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)N MCULE-9372091760 [0,2,0,0,0,0|1,0,0]=3 5177 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)O MCULE-1752010928 [0,2,0,0,0,0|1,0,0]=3 5178 B11R1.23 COC(=O)[C@@H]1CCC[C@H](C1)O MCULE-3751397536 [0,2,0,0,0,0|1,0,0]=3 5179 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-1187786030 [0,2,0,0,0,0|2,0,0]=4 5180 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-1554892534 [0,2,0,0,0,0|2,0,0]=4 5181 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-5013221855 [0,2,0,0,0,0|2,0,0]=4 5182 B11R1.23 COC(=O)[C@@H]1CCN[C@@H](C1)C MCULE-9993392560 [0,2,0,0,0,0|2,0,0]=4 5183 B11R1.23 COC(=O)[C@@H]1CNCC(=O)N1 MCULE-2739256690 [0,2,0,0,0,0|1,0,1]=4 5184 B11R1.23 COC(=O)[C@@H]1CNCC(=O)N1 MCULE-5386964384 [0,2,0,0,0,0|1,0,1]=4 5185 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O1)C MCULE-1023461283 [0,2,0,0,0,0|1,0,0]=3 5186 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](O1)C MCULE-8404158859 [0,2,0,0,0,0|1,0,0]=3 5187 B11R1.23 COC(=O)[C@@H]1COCC(=O)C1 MCULE-3601624499 [0,2,0,0,0,0|1,0,1]=4 5188 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-1560155771 [0,2,0,0,0,0|2,0,0]=4 5189 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-4264457030 [0,2,0,0,0,0|2,0,0]=4 5190 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-6232000722 [0,2,0,0,0,0|2,0,0]=4 5191 B11R1.23 COC(=O)[C@@H]1C[C@@H](CCN1)O MCULE-8711787558 [0,2,0,0,0,0|2,0,0]=4 5192 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-4467656117 [0,2,0,0,0,0|2,0,0]=4 5193 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-5992101405 [0,2,0,0,0,0|2,0,0]=4 5194 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-6317611644 [0,2,0,0,0,0|2,0,0]=4 5195 B11R1.23 COC(=O)[C@@H]1C[C@H](CCN1)O MCULE-6996533131 [0,2,0,0,0,0|2,0,0]=4 5196 B11R1.23 COC(=O)[C@H]1CC=C[C@H](C1)O MCULE-9306178186 [0,2,0,0,0,0|1,0,1]=4 5197 B11R1.23 COC(=O)[C@H]1CCCC(=O)C1 MCULE-1252511775 [0,2,0,0,0,0|1,0,0]=3 5198 B11R1.23 COC(=O)[C@H]1CCCC(=O)N1 MCULE-8974857056 [0,2,0,0,0,0|2,0,0]=4 5199 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)C MCULE-8236622513 [0,2,0,0,0,0|1,0,0]=3 5200 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-2543113082 [0,2,0,0,0,0|1,0,0]=3 5201 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-6222782588 [0,2,0,0,0,0|1,0,0]=3 5202 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-6374651784 [0,2,0,0,0,0|1,0,0]=3 5203 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)N MCULE-9189210669 [0,2,0,0,0,0|1,0,0]=3 5204 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)O MCULE-1036732191 [0,2,0,0,0,0|1,0,0]=3 5205 B11R1.23 COC(=O)[C@H]1CCC[C@@H](C1)O MCULE-7022445698 [0,2,0,0,0,0|1,0,0]=3 5206 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-1272125797 [0,2,0,0,0,0|1,0,0]=3 5207 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-3188707822 [0,2,0,0,0,0|1,0,0]=3 5208 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-4975583110 [0,2,0,0,0,0|1,0,0]=3 5209 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)N MCULE-8631497838 [0,2,0,0,0,0|1,0,0]=3 5210 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)O MCULE-2298116384 [0,2,0,0,0,0|1,0,0]=3 5211 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)O MCULE-4413710460 [0,2,0,0,0,0|1,0,0]=3 5212 B11R1.23 COC(=O)[C@H]1CCC[C@H](C1)O MCULE-9938371951 [0,2,0,0,0,0|1,0,0]=3 5213 B11R1.23 COC(=O)[C@H]1CCNC(=O)C1 MCULE-9706628315 [0,2,0,0,0,0|2,0,0]=4 5214 B11R1.23 COC(=O)[C@H]1CCN[C@H](C1)C MCULE-3661641129 [0,2,0,0,0,0|2,0,0]=4 5215 B11R1.23 COC(=O)[C@H]1CCN[C@H](C1)C MCULE-4187055827 [0,2,0,0,0,0|2,0,0]=4 5216 B11R1.23 COC(=O)[C@H]1CNCC(=O)N1 MCULE-7434283814 [0,2,0,0,0,0|1,0,1]=4 5217 B11R1.23 COC(=O)[C@H]1CNCC(=O)N1 MCULE-9904980974 [0,2,0,0,0,0|1,0,1]=4 5218 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C1)C MCULE-5522834072 [0,2,0,0,0,0|0,0,0]=2 5219 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C1)C MCULE-7069305041 [0,2,0,0,0,0|0,0,0]=2 5220 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C1)C MCULE-8819293670 [0,2,0,0,0,0|0,0,0]=2 5221 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-1230934148 [0,2,0,0,0,0|0,0,0]=2 5222 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-4518893761 [0,2,0,0,0,0|0,0,0]=2 5223 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-6242107437 [0,2,0,0,0,0|0,0,0]=2 5224 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-6759485266 [0,2,0,0,0,0|0,0,0]=2 5225 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-7286083039 [0,2,0,0,0,0|0,0,0]=2 5226 B11R1.23 COC(=O)[C@H]1CNC[C@H](C1)C MCULE-8529284501 [0,2,0,0,0,0|0,0,0]=2 5227 B11R1.23 COC(=O)[C@H]1C[C@@H](CCN1)O MCULE-3855809627 [0,2,0,0,0,0|2,0,0]=4 5228 B11R1.23 COC(=O)[C@H]1C[C@@H](CCN1)O MCULE-9652933218 [0,2,0,0,0,0|2,0,0]=4 5229 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-5894001253 [0,2,0,0,0,0|2,0,0]=4 5230 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-7416859347 [0,2,0,0,0,0|2,0,0]=4 5231 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-7542782600 [0,2,0,0,0,0|2,0,0]=4 5232 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-7582287818 [0,2,0,0,0,0|2,0,0]=4 5233 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-8181619832 [0,2,0,0,0,0|2,0,0]=4 5234 B11R1.23 COC(=O)[C@H]1C[C@H](CCN1)O MCULE-9706236638 [0,2,0,0,0,0|2,0,0]=4 5235 B11R1.23 [C@H]1(CCN[C@H](C1)C(=O)OC)O MCULE-1156229977 [0,2,0,0,0,0|2,0,0]=4 5236 B11R1.23 [C@H]1(CCN[C@H](C1)C(=O)OC)O MCULE-8722743074 [0,2,0,0,0,0|2,0,0]=4 5237 B11R1.23 [C@H]1(C[C@@H](CCN1)C(=O)OC)C MCULE-1747332778 [0,2,0,0,0,0|2,0,0]=4 5238 B11R1.23 [C@H]1(C[C@@H](CCN1)C(=O)OC)C MCULE-7292173126 [0,2,0,0,0,0|2,0,0]=4 5239 B11R1.222 CNC(=O)C1CCCCC1N MCULE-4756256881 [0,2,0,0,0,0|2,0,0]=4 5240 B11R1.222 CNC(=O)C1CNCCN1C MCULE-2538155935 [0,2,0,0,0,0|2,0,0]=4 5241 B11R1.222 CNC(=O)C1CNCCN1C MCULE-8428547101 [0,2,0,0,0,0|2,0,0]=4 5242 B11R1.222 COC(=O)C1CC=CCC1N MCULE-2910715817 [0,2,0,0,0,0|1,0,1]=4 5243 B11R1.222 COC(=O)C1CC=CCC1N MCULE-8325331359 [0,2,0,0,0,0|1,0,1]=4 5244 B11R1.222 COC(=O)C1CCCCC1=O MCULE-4349966830 [0,2,0,0,0,0|1,0,1]=4 5245 B11R1.222 COC(=O)C1CCCCC1N MCULE-1825299804 [0,2,0,0,0,0|1,0,0]=3 5246 B11R1.222 COC(=O)C1CCCCC1N MCULE-4137070739 [0,2,0,0,0,0|1,0,0]=3 5247 B11R1.222 COC(=O)C1CCCCC1O MCULE-5625433366 [0,2,0,0,0,0|1,0,0]=3 5248 B11R1.222 COC(=O)C1CCCCN1C MCULE-8053559173 [0,2,0,0,0,0|2,0,0]=4 5249 B11R1.222 COC(=O)C1CCCCN1O MCULE-7652880533 [0,2,0,0,0,0|2,0,0]=4 5250 B11R1.222 COC(=O)C1CCCNC1=O MCULE-9689390494 [0,2,0,0,0,0|0,0,1]=3 5251 B11R1.222 COC(=O)C1CCCNC1C MCULE-4090993645 [0,2,0,0,0,0|0,0,0]=2 5252 B11R1.222 COC(=O)C1CCCNC1C MCULE-4200305359 [0,2,0,0,0,0|0,0,0]=2 5253 B11R1.222 COC(=O)C1CCNCC1C MCULE-7624789928 [0,2,0,0,0,0|2,0,0]=4 5254 B11R1.222 COC(=O)C1CCNCC1C MCULE-8344260310 [0,2,0,0,0,0|2,0,0]=4 5255 B11R1.222 COC(=O)C1CCNCC1F MCULE-3759747925 [0,2,0,0,0,0|2,0,0]=4 5256 B11R1.222 COC(=O)C1CCNCC1F MCULE-9836086162 [0,2,0,0,0,0|2,0,0]=4 5257 B11R1.222 COC(=O)C1CNCCC1=O MCULE-3533971761 [0,2,0,0,0,0|0,0,1]=3 5258 B11R1.222 COC(=O)C1CNCCC1=O MCULE-4815215072 [0,2,0,0,0,0|0,0,1]=3 5259 B11R1.222 COC(=O)C1CNCCC1C MCULE-3273710064 [0,2,0,0,0,0|0,0,0]=2 5260 B11R1.222 COC(=O)C1CNCCC1C MCULE-9474733870 [0,2,0,0,0,0|0,0,0]=2 5261 B11R1.222 COC(=O)C1CNCCC1O MCULE-1087796666 [0,2,0,0,0,0|0,0,0]=2 5262 B11R1.222 COC(=O)C1CNCCC1O MCULE-3371223887 [0,2,0,0,0,0|0,0,0]=2 5263 B11R1.222 COC(=O)C1CNCCN1C MCULE-3204660252 [0,2,0,0,0,0|1,0,0]=3 5264 B11R1.222 COC(=O)C1COCCC1=O MCULE-9088923995 [0,2,0,0,0,0|1,0,1]=4 5265 B11R1.222 COC(=O)C1COCCC1N MCULE-1504849706 [0,2,0,0,0,0|1,0,0]=3 5266 B11R1.222 COC(=O)C1COCCN1C MCULE-8282493051 [0,2,0,0,0,0|2,0,0]=4 5267 B11R1.222 COC(=O)C1CSCCC1=O MCULE-2358081361 [0,2,0,0,0,0|1,0,1]=4 5268 B11R1.222 COC(=O)C1NCCCC1C MCULE-4240891821 [0,2,0,0,0,0|2,0,0]=4 5269 B11R1.222 COC(=O)C1NCCCC1C MCULE-4887956825 [0,2,0,0,0,0|2,0,0]=4 5270 B11R1.222 COC(=O)C1NCCCC1O MCULE-7175985212 [0,2,0,0,0,0|2,0,0]=4 5271 B11R1.222 COC(=O)C1NCCCC1O MCULE-8696579515 [0,2,0,0,0,0|2,0,0]=4 5272 B11R1.222 COC(=O)C1NCCNC1=O MCULE-5227226268 [0,2,0,0,0,0|1,0,1]=4 5273 B11R1.222 COC(=O)C1NCCNC1=O MCULE-5997128624 [0,2,0,0,0,0|1,0,1]=4 5274 B11R1.222 COC(=O)C1NCCOC1C MCULE-7481378868 [0,2,0,0,0,0|2,0,0]=4 5275 B11R1.222 COC(=O)C1NCCOC1C MCULE-8115578923 [0,2,0,0,0,0|2,0,0]=4 5276 B11R1.222 COC(=O)C1SCCNC1=O MCULE-3776980080 [0,2,0,0,0,0|1,0,1]=4 5277 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1N MCULE-3760129587 [0,2,0,0,0,0|1,0,0]=3 5278 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1N MCULE-7526276286 [0,2,0,0,0,0|1,0,0]=3 5279 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1O MCULE-2744100865 [0,2,0,0,0,0|1,0,0]=3 5280 B11R1.222 COC(=O)[C@@H]1CCCC[C@@H]1O MCULE-4997449445 [0,2,0,0,0,0|1,0,0]=3 5281 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-2322146114 [0,2,0,0,0,0|1,0,0]=3 5282 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-2671634853 [0,2,0,0,0,0|1,0,0]=3 5283 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-8874981464 [0,2,0,0,0,0|1,0,0]=3 5284 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-8895226982 [0,2,0,0,0,0|1,0,0]=3 5285 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-9015389744 [0,2,0,0,0,0|1,0,0]=3 5286 B11R1.222 COC(=O)[C@@H]1CCCC[C@H]1N MCULE-9606268315 [0,2,0,0,0,0|1,0,0]=3 5287 B11R1.222 COC(=O)[C@@H]1CCCN[C@@H]1C MCULE-4860895329 [0,2,0,0,0,0|0,0,0]=2 5288 B11R1.222 COC(=O)[C@@H]1CCCN[C@@H]1C MCULE-8654537084 [0,2,0,0,0,0|0,0,0]=2 5289 B11R1.222 COC(=O)[C@@H]1CCCN[C@H]1C MCULE-7498048591 [0,2,0,0,0,0|0,0,0]=2 5290 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-4676728316 [0,2,0,0,0,0|2,0,0]=4 5291 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-4693869526 [0,2,0,0,0,0|2,0,0]=4 5292 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-6672831529 [0,2,0,0,0,0|2,0,0]=4 5293 B11R1.222 COC(=O)[C@@H]1CCNC[C@@H]1C MCULE-8735606409 [0,2,0,0,0,0|2,0,0]=4 5294 B11R1.222 COC(=O)[C@@H]1CNCC[C@@H]1C MCULE-4956578565 [0,2,0,0,0,0|0,0,0]=2 5295 B11R1.222 COC(=O)[C@@H]1CNCC[C@@H]1C MCULE-6306125390 [0,2,0,0,0,0|0,0,0]=2 5296 B11R1.222 COC(=O)[C@@H]1CNCC[C@H]1C MCULE-1098365784 [0,2,0,0,0,0|0,0,0]=2 5297 B11R1.222 COC(=O)[C@@H]1CNCC[C@H]1C MCULE-6581985698 [0,2,0,0,0,0|0,0,0]=2 5298 B11R1.222 COC(=O)[C@@H]1COCCC1=O MCULE-3605218711 [0,2,0,0,0,0|1,0,1]=4 5299 B11R1.222 COC(=O)[C@@H]1COCC[C@@H]1N MCULE-1061149990 [0,2,0,0,0,0|1,0,0]=3 5300 B11R1.222 COC(=O)[C@@H]1COCC[C@@H]1N MCULE-6747132947 [0,2,0,0,0,0|1,0,0]=3 5301 B11R1.222 COC(=O)[C@@H]1COCC[C@H]1N MCULE-7185366042 [0,2,0,0,0,0|1,0,0]=3 5302 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-3421501449 [0,2,0,0,0,0|1,0,0]=3 5303 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-4527749095 [0,2,0,0,0,0|1,0,0]=3 5304 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-5241465045 [0,2,0,0,0,0|1,0,0]=3 5305 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N MCULE-9223863052 [0,2,0,0,0,0|1,0,0]=3 5306 B11R1.222 COC(=O)[C@H]1CCCN[C@@H]1C MCULE-2757355307 [0,2,0,0,0,0|0,0,0]=2 5307 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C MCULE-3385138275 [0,2,0,0,0,0|0,0,0]=2 5308 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C MCULE-4359847105 [0,2,0,0,0,0|0,0,0]=2 5309 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C MCULE-7058619393 [0,2,0,0,0,0|0,0,0]=2 5310 B11R1.222 COC(=O)[C@H]1CNCC[C@@H]1C MCULE-7100934081 [0,2,0,0,0,0|0,0,0]=2 5311 B11R1.222 COC(=O)[C@H]1CNCC[C@@H]1C MCULE-9285767505 [0,2,0,0,0,0|0,0,0]=2 5312 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-2607251792 [0,2,0,0,0,0|0,0,0]=2 5313 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-3363958778 [0,2,0,0,0,0|0,0,0]=2 5314 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-3805360011 [0,2,0,0,0,0|0,0,0]=2 5315 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1C MCULE-7618725820 [0,2,0,0,0,0|0,0,0]=2 5316 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1O MCULE-4220266073 [0,2,0,0,0,0|0,0,0]=2 5317 B11R1.222 COC(=O)[C@H]1CNCC[C@H]1O MCULE-5734890382 [0,2,0,0,0,0|0,0,0]=2 5318 B11R1.222 COC(=O)[C@H]1COCC[C@@H]1N MCULE-1850201908 [0,2,0,0,0,0|1,0,0]=3 5319 B11R1.222 COC(=O)[C@H]1COCC[C@@H]1N MCULE-4352205617 [0,2,0,0,0,0|1,0,0]=3 5320 B11R1.222 COC(=O)[C@H]1COCC[C@H]1N MCULE-8034571931 [0,2,0,0,0,0|1,0,0]=3 5321 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-3063776541 [0,2,0,0,0,0|2,0,0]=4 5322 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-5946883789 [0,2,0,0,0,0|2,0,0]=4 5323 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-6952115958 [0,2,0,0,0,0|2,0,0]=4 5324 B11R1.222 COC(=O)[C@H]1NCCC[C@H]1C MCULE-7399475599 [0,2,0,0,0,0|2,0,0]=4 5325 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-1027378651 [0,2,0,0,0,0|2,0,0]=4 5326 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-4535362622 [0,2,0,0,0,0|2,0,0]=4 5327 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-6155846476 [0,2,0,0,0,0|2,0,0]=4 5328 B11R1.222 COC(=O)[C@H]1NCCO[C@@H]1C MCULE-7704553510 [0,2,0,0,0,0|2,0,0]=4 5329 B11R1.222 NNC(=O)C1CCCNC1=O MCULE-8543187633 [0,2,0,0,0,0|1,0,1]=4 5330 B11R1.878 CC(=NO)C1(CCCCC1)O MCULE-2919413764 [0,2,0,0,0,0|2,0,0]=4 5331 B11R1.878 CNC(=O)C1(CCCCC1)N MCULE-1205176044 [0,2,0,0,0,0|2,0,0]=4 5332 B11R1.878 CNC(=O)C1(CCCCC1)N MCULE-5586151094 [0,2,0,0,0,0|2,0,0]=4 5333 B11R1.878 CNC(=O)C1(CCCNC1)C MCULE-4099432918 [0,2,0,0,0,0|1,0,0]=3 5334 B11R1.878 CNC(=O)C1(CCCNC1)C MCULE-4411241332 [0,2,0,0,0,0|1,0,0]=3 5335 B11R1.878 CNC(=O)C1(CNCCO1)C MCULE-7983487311 [0,2,0,0,0,0|2,0,0]=4 5336 B11R1.878 COC(=O)C1(CCCCC1)Br MCULE-1324398852 [0,2,0,0,0,0|1,0,0]=3 5337 B11R1.878 COC(=O)C1(CCCCC1)C MCULE-1116173481 [0,2,0,0,0,0|1,0,0]=3 5338 B11R1.878 COC(=O)C1(CCCCC1)N MCULE-2077713130 [0,2,0,0,0,0|1,0,0]=3 5339 B11R1.878 COC(=O)C1(CCCCC1)N MCULE-5529190912 [0,2,0,0,0,0|1,0,0]=3 5340 B11R1.878 COC(=O)C1(CCCCC1)O MCULE-7312981015 [0,2,0,0,0,0|1,0,0]=3 5341 B11R1.878 COC(=O)C1(CCCCN1)C MCULE-1190264508 [0,2,0,0,0,0|2,0,0]=4 5342 B11R1.878 COC(=O)C1(CCCCN1)C MCULE-3258376100 [0,2,0,0,0,0|2,0,0]=4 5343 B11R1.878 COC(=O)C1(CCCCO1)C MCULE-4831752163 [0,2,0,0,0,0|2,0,0]=4 5344 B11R1.878 COC(=O)C1(CCCNC1)C MCULE-2912960772 [0,2,0,0,0,0|0,0,0]=2 5345 B11R1.878 COC(=O)C1(CCCNC1)C MCULE-6748274783 [0,2,0,0,0,0|0,0,0]=2 5346 B11R1.878 COC(=O)C1(CCCNC1)O MCULE-4695147180 [0,2,0,0,0,0|0,0,0]=2 5347 B11R1.878 COC(=O)C1(CCCNC1)O MCULE-7996251761 [0,2,0,0,0,0|0,0,0]=2 5348 B11R1.878 COC(=O)C1(CCCOC1)C MCULE-6519149185 [0,2,0,0,0,0|1,0,0]=3 5349 B11R1.878 COC(=O)C1(CCNCC1)C MCULE-1287601384 [0,2,0,0,0,0|2,0,0]=4 5350 B11R1.878 COC(=O)C1(CCNCC1)C MCULE-5120199516 [0,2,0,0,0,0|2,0,0]=4 5351 B11R1.878 COC(=O)C1(CCNCC1)F MCULE-2369065610 [0,2,0,0,0,0|2,0,0]=4 5352 B11R1.878 COC(=O)C1(CCNCC1)F MCULE-3197182658 [0,2,0,0,0,0|2,0,0]=4 5353 B11R1.878 COC(=O)C1(CCNCC1)N MCULE-7457516879 [0,2,0,0,0,0|2,0,0]=4 5354 B11R1.878 COC(=O)C1(CCNCC1)N MCULE-8838613115 [0,2,0,0,0,0|2,0,0]=4 5355 B11R1.878 COC(=O)C1(CCNCC1)O MCULE-3066342819 [0,2,0,0,0,0|2,0,0]=4 5356 B11R1.878 COC(=O)C1(CCNCC1)O MCULE-9440891544 [0,2,0,0,0,0|2,0,0]=4 5357 B11R1.878 COC(=O)C1(CCOCC1)Br MCULE-7180907923 [0,2,0,0,0,0|2,0,0]=4 5358 B11R1.878 COC(=O)C1(CCOCC1)C MCULE-2899247948 [0,2,0,0,0,0|2,0,0]=4 5359 B11R1.878 COC(=O)C1(CCOCC1)F MCULE-7433586839 [0,2,0,0,0,0|2,0,0]=4 5360 B11R1.878 COC(=O)C1(CCOCC1)N MCULE-2933369256 [0,2,0,0,0,0|2,0,0]=4 5361 B11R1.878 COC(=O)C1(CCOCC1)N MCULE-5766956671 [0,2,0,0,0,0|2,0,0]=4 5362 B11R1.878 COC(=O)C1(CCOCC1)N MCULE-6987517348 [0,2,0,0,0,0|2,0,0]=4 5363 B11R1.878 COC(=O)C1(CCOCC1)O MCULE-2689620350 [0,2,0,0,0,0|2,0,0]=4 5364 B11R1.878 COC(=O)C1(CCSCC1)N MCULE-3245318067 [0,2,0,0,0,0|2,0,0]=4 5365 B11R1.878 COC(=O)C1(CCSCC1)N MCULE-5736843966 [0,2,0,0,0,0|2,0,0]=4 5366 B11R1.878 COC(=O)C1(CCSCC1)O MCULE-9114884346 [0,2,0,0,0,0|2,0,0]=4 5367 B11R1.878 COC(=O)C1(CNCCO1)C MCULE-2710510669 [0,2,0,0,0,0|1,0,0]=3 5368 B11R1.878 COC(=O)C1(CNCCO1)C MCULE-6281859428 [0,2,0,0,0,0|1,0,0]=3 5369 B11R1.878 COC(=O)C1(COCCN1)C MCULE-6477520944 [0,2,0,0,0,0|2,0,0]=4 5370 B11R1.878 COC(=O)C1(COCCN1)C MCULE-7448041002 [0,2,0,0,0,0|2,0,0]=4 5371 B11R1.878 COC(=O)[C@@]1(CCCCN1)C MCULE-9054004047 [0,2,0,0,0,0|2,0,0]=4 5372 B11R1.878 COC(=O)[C@@]1(COCCN1)C MCULE-1062911013 [0,2,0,0,0,0|2,0,0]=4 5373 B11R1.878 COC(=O)[C@@]1(COCCN1)C MCULE-9828449382 [0,2,0,0,0,0|2,0,0]=4 5374 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-1448662011 [0,2,0,0,0,0|2,0,0]=4 5375 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-3553596882 [0,2,0,0,0,0|2,0,0]=4 5376 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-8150000624 [0,2,0,0,0,0|2,0,0]=4 5377 B11R1.878 COC(=O)[C@]1(COCCN1)C MCULE-9063986834 [0,2,0,0,0,0|2,0,0]=4 5378 B11R1.878 N/C(=N/O)/C1(CCCCC1)O MCULE-7526944829 [0,2,0,0,0,0|2,0,0]=4 5379 B11R1.878 O=C(CO)C1(CCCCC1)O MCULE-4883134314 [0,2,0,0,0,0|1,0,0]=3 5380 B11R1.87 O=P(O)(O)C1CCCCC1O MCULE-7151108069 [0,2,0,0,0,0|2,0,0]=4 5381 B11R1.53 CCC1CCCCC1C(=O)O MCULE-7668550184 [0,2,0,0,0,0|1,0,0]=3 5382 B11R1.53 CCN1CCCCC1C(=O)O MCULE-4498923070 [0,2,0,0,0,0|2,0,0]=4 5383 B11R1.53 CCN1CCCCC1C(=O)O MCULE-7899898030 [0,2,0,0,0,0|2,0,0]=4 5384 B11R1.53 CCN1CCOCC1C(=O)O MCULE-5700522196 [0,2,0,0,0,0|2,0,0]=4 5385 B11R1.53 COC1CCCCC1C(=O)O MCULE-6019948868 [0,2,0,0,0,0|1,0,0]=3 5386 B11R1.53 NC(=O)[C@H]1CCCC[C@@H]1CO MCULE-2660751861 [0,2,0,0,0,0|2,0,0]=4 5387 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1165595049 [0,2,0,0,0,0|1,0,0]=3 5388 B11R1.53 NC[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4991619146 [0,2,0,0,0,0|1,0,0]=3 5389 B11R1.53 O=NN1CCCCC1C(=O)O MCULE-4341720324 [0,2,0,0,0,0|2,0,0]=4 5390 B11R1.159 CN1C(=O)CCCC1C(=O)O MCULE-2434427513 [0,2,0,0,0,0|2,0,0]=4 5391 B11R1.159 CN1CCOC(C1=O)C(=O)O MCULE-3390921654 [0,2,0,0,0,0|1,0,1]=4 5392 B11R1.159 O=C(O)C1CCCC(C1=O)Br MCULE-3186177717 [0,2,0,0,0,0|1,0,1]=4 5393 B11R1.167 CC(=O)C1CN(CCN1C)C MCULE-6629019834 [0,2,0,0,0,0|2,0,0]=4 5394 B11R1.167 CN1CCN(C(C1)C(=O)O)C MCULE-6290479918 [0,2,0,0,0,0|1,0,0]=3 5395 B11R1.167 CN1CCN(C(C1)C(=O)O)C MCULE-8670086906 [0,2,0,0,0,0|1,0,0]=3 5396 B11R1.167 CN1CCN([C@@H](C1)C(=O)O)C MCULE-6955851048 [0,2,0,0,0,0|1,0,0]=3 5397 B11R1.167 CN1CCN([C@@H](C1)C(=O)O)C MCULE-7191641614 [0,2,0,0,0,0|1,0,0]=3 5398 B11R1.167 CN1CCN([C@H](C1)C(=O)O)C MCULE-3765574199 [0,2,0,0,0,0|1,0,0]=3 5399 B11R1.167 CN1CCN([C@H](C1)C(=O)O)C MCULE-6324425972 [0,2,0,0,0,0|1,0,0]=3 5400 B11R1.167 CN1CC[C@H]([C@@H](C1)C(=O)O)O MCULE-3460047813 [0,2,0,0,0,0|0,0,0]=2 5401 B11R1.177 CC1(CCCCC1C(=O)O)C MCULE-4989852289 [0,2,0,0,0,0|1,0,0]=3 5402 B11R1.177 CC1(CCCCC1C(=O)O)N MCULE-1044966713 [0,2,0,0,0,0|1,0,0]=3 5403 B11R1.177 CC1(CCCCC1C(=O)O)N MCULE-6249137013 [0,2,0,0,0,0|1,0,0]=3 5404 B11R1.177 CC1(CCCNC1C(=O)O)C MCULE-2919768330 [0,2,0,0,0,0|2,0,0]=4 5405 B11R1.177 CC1(CCCNC1C(=O)O)C MCULE-3333782777 [0,2,0,0,0,0|2,0,0]=4 5406 B11R1.177 CC1(CNCCC1C(=O)O)C MCULE-6439138928 [0,2,0,0,0,0|2,0,0]=4 5407 B11R1.177 CC1(COCCC1C(=O)O)C MCULE-5824022501 [0,2,0,0,0,0|2,0,0]=4 5408 B11R1.177 CC1(OCCOC1C(=O)O)C MCULE-8997848711 [0,2,0,0,0,0|2,0,0]=4 5409 B11R1.177 CC1(OCCO[C@@H]1C(=O)O)C MCULE-6292978884 [0,2,0,0,0,0|2,0,0]=4 5410 B11R1.177 CC1(SCCNC1C(=O)O)C MCULE-3784579016 [0,2,0,0,0,0|2,0,0]=4 5411 B11R1.177 CC1(SCCN[C@@H]1C(=O)O)C MCULE-1576755405 [0,2,0,0,0,0|2,0,0]=4 5412 B11R1.177 CC1(SCCN[C@@H]1C(=O)O)C MCULE-3460414431 [0,2,0,0,0,0|2,0,0]=4 5413 B11R1.177 C[C@@]1(CCCC[C@H]1C(=O)O)N MCULE-6684164155 [0,2,0,0,0,0|1,0,0]=3 5414 B11R1.177 C[C@]1(CCCC[C@@H]1C(=O)O)N MCULE-2495356747 [0,2,0,0,0,0|1,0,0]=3 5415 B11R1.177 C[C@]1(CCCC[C@@H]1C(=O)O)N MCULE-4525597115 [0,2,0,0,0,0|1,0,0]=3 5416 B11R1.177 O=C(O)C1CCCCC1(F)F MCULE-7249376708 [0,2,0,0,0,0|1,0,0]=3 5417 B11R1.177 O=C(O)C1CCNCC1(F)F MCULE-1987617135 [0,2,0,0,0,0|2,0,0]=4 5418 B11R1.177 O=C(O)C1CCNCC1(F)F MCULE-2892154857 [0,2,0,0,0,0|2,0,0]=4 5419 B11R1.177 O=C(O)C1CNCCC1(F)F MCULE-1684594912 [0,2,0,0,0,0|0,0,0]=2 5420 B11R1.177 O=C(O)C1CNCCC1(F)F MCULE-4182492143 [0,2,0,0,0,0|0,0,0]=2 5421 B11R1.177 O=C(O)C1COCCC1(F)F MCULE-7019190515 [0,2,0,0,0,0|1,0,0]=3 5422 B11R1.177 O=C(O)[C@H]1CCNCC1(F)F MCULE-2016837162 [0,2,0,0,0,0|2,0,0]=4 5423 B11R1.177 O=C(O)[C@H]1CCNCC1(F)F MCULE-5938396977 [0,2,0,0,0,0|2,0,0]=4 5424 B11R1.520 CC1(CCCNC1=O)C(=O)O MCULE-2127943120 [0,2,0,0,0,0|0,0,1]=3 5425 B11R1.520 CC1CCCCC1(N)C(=O)O MCULE-7674467260 [0,2,0,0,0,0|1,0,0]=3 5426 B11R1.520 CC1CCCCC1(O)C(=O)O MCULE-4831471383 [0,2,0,0,0,0|1,0,0]=3 5427 B11R1.520 CN1CCCCC1(C)C(=O)O MCULE-8543610232 [0,2,0,0,0,0|2,0,0]=4 5428 B11R1.520 O=C(O)C1(CCCC=C1F)F MCULE-5027309828 [0,2,0,0,0,0|1,0,1]=4 5429 B11R1.74 CC(=O)C1CC(CC(C1)C)C MCULE-3304279258 [0,2,0,0,0,0|2,0,0]=4 5430 B11R1.74 CC1CC(CC(C1)C(=O)O)C MCULE-4414065035 [0,2,0,0,0,0|1,0,0]=3 5431 B11R1.74 CC1CC(CC(O1)C)C(=O)O MCULE-8718069513 [0,2,0,0,0,0|2,0,0]=4 5432 B11R1.74 CC1CN(CC(O1)C(=O)O)C MCULE-1120383485 [0,2,0,0,0,0|1,0,0]=3 5433 B11R1.74 CC1CN(CC(O1)C(=O)O)C MCULE-4331152110 [0,2,0,0,0,0|1,0,0]=3 5434 B11R1.74 C[C@@H]1CC(C[C@@H](C1)C)C(=O)O MCULE-8476320504 [0,2,0,0,0,0|1,0,0]=3 5435 B11R1.74 C[C@@H]1C[C@@H](C[C@@H](C1)C)C(=O)O MCULE-7313940085 [0,2,0,0,0,0|1,0,0]=3 5436 B11R1.74 C[C@H]1CC(C[C@H](N1)C)C(=O)O MCULE-2237943409 [0,2,0,0,0,0|2,0,0]=4 5437 B11R1.74 C[C@H]1CC(C[C@H](N1)C)C(=O)O MCULE-4813276637 [0,2,0,0,0,0|2,0,0]=4 5438 B11R1.74 C[C@H]1CC(C[C@H](O1)C)C(=O)O MCULE-3337799083 [0,2,0,0,0,0|2,0,0]=4 5439 B11R1.74 O=C1CC(=O)CC(C1)C(=O)O MCULE-2619134082 [0,2,0,0,0,0|1,0,1]=4 5440 B11R1.266 CCC1CC(CCO1)C(=O)O MCULE-2078111514 [0,2,0,0,0,0|2,0,0]=4 5441 B11R1.266 CCC1CCCC(N1)C(=O)O MCULE-7713794654 [0,2,0,0,0,0|2,0,0]=4 5442 B11R1.266 CCN1CCCC(C1)C(=O)C MCULE-7135351580 [0,2,0,0,0,0|1,0,0]=3 5443 B11R1.266 CCN1CCCC(C1)C(=O)O MCULE-6025646187 [0,2,0,0,0,0|0,0,0]=2 5444 B11R1.266 CCN1CCCC(C1)C(=O)O MCULE-9624023787 [0,2,0,0,0,0|0,0,0]=2 5445 B11R1.266 CCN1CCOC(C1)C(=O)O MCULE-2517957161 [0,2,0,0,0,0|1,0,0]=3 5446 B11R1.266 CCN1CCOC(C1)C(=O)O MCULE-7367864264 [0,2,0,0,0,0|1,0,0]=3 5447 B11R1.266 COC1CCCC(C1)C(=O)O MCULE-5456384162 [0,2,0,0,0,0|1,0,0]=3 5448 B11R1.266 COC1CCNC(C1)C(=O)O MCULE-4331709048 [0,2,0,0,0,0|2,0,0]=4 5449 B11R1.266 COC1CCNC(C1)C(=O)O MCULE-4664523841 [0,2,0,0,0,0|2,0,0]=4 5450 B11R1.266 CO[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-3625899999 [0,2,0,0,0,0|2,0,0]=4 5451 B11R1.266 CO[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5992517897 [0,2,0,0,0,0|2,0,0]=4 5452 B11R1.266 CO[C@H]1CCC[C@H](C1)C(=O)O MCULE-4087120684 [0,2,0,0,0,0|1,0,0]=3 5453 B11R1.266 CO[C@H]1CCN[C@@H](C1)C(=O)O MCULE-9935444947 [0,2,0,0,0,0|2,0,0]=4 5454 B11R1.266 CO[C@H]1CCN[C@H](C1)C(=O)O MCULE-1244366233 [0,2,0,0,0,0|2,0,0]=4 5455 B11R1.266 O=C(O)C1CCCC(=NO)C1 MCULE-8609222770 [0,2,0,0,0,0|1,0,0]=3 5456 B11R1.266 O=C(O)C1CCCC(C1)CO MCULE-5244716212 [0,2,0,0,0,0|1,0,0]=3 5457 B11R1.266 O=CN1CCCC(C1)C(=O)O MCULE-9603483269 [0,2,0,0,0,0|0,0,0]=2 5458 B11R1.667 CC1(CC(CCO1)N)C(=O)O MCULE-4479358294 [0,2,0,0,0,0|2,0,0]=4 5459 B11R1.667 CC1(CC(CCO1)N)C(=O)O MCULE-7328807092 [0,2,0,0,0,0|2,0,0]=4 5460 B11R1.667 CC1(CCNC(=O)C1)C(=O)O MCULE-9095450827 [0,2,0,0,0,0|2,0,0]=4 5461 B11R1.667 CC1CC(CCO1)(C)C(=O)O MCULE-8913886133 [0,2,0,0,0,0|2,0,0]=4 5462 B11R1.667 CC1CC(CCO1)(N)C(=O)O MCULE-2481658934 [0,2,0,0,0,0|2,0,0]=4 5463 B11R1.667 CC1CC(CCO1)(N)C(=O)O MCULE-5146905630 [0,2,0,0,0,0|2,0,0]=4 5464 B11R1.667 CC1CCCC(C1)(N)C(=O)N MCULE-1803408408 [0,2,0,0,0,0|2,0,0]=4 5465 B11R1.667 CC1CCCC(C1)(N)C(=O)O MCULE-7952794030 [0,2,0,0,0,0|1,0,0]=3 5466 B11R1.667 CN1CCCC(C1)(C)C(=O)O MCULE-6176737385 [0,2,0,0,0,0|0,0,0]=2 5467 B11R1.730 CC1(CC(CCN1)C(=O)O)C MCULE-8159392480 [0,2,0,0,0,0|2,0,0]=4 5468 B11R1.730 CC1(CC(CCO1)C(=O)O)C MCULE-5978480117 [0,2,0,0,0,0|2,0,0]=4 5469 B11R1.730 CC1(CCCC(C1)C(=O)O)C MCULE-1597122526 [0,2,0,0,0,0|1,0,0]=3 5470 B11R1.730 CC1(CCCC(O1)C(=O)O)C MCULE-6134883479 [0,2,0,0,0,0|2,0,0]=4 5471 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-1186852121 [0,2,0,0,0,0|2,0,0]=4 5472 B11R1.730 CC1(CCNC(C1)C(=O)O)C MCULE-5031883785 [0,2,0,0,0,0|2,0,0]=4 5473 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-3850941228 [0,2,0,0,0,0|1,0,0]=3 5474 B11R1.730 CC1(CNCC(O1)C(=O)O)C MCULE-4368873526 [0,2,0,0,0,0|1,0,0]=3 5475 B11R1.730 CC1(COCC(N1)C(=O)O)C MCULE-9878578908 [0,2,0,0,0,0|2,0,0]=4 5476 B11R1.730 CC1(COCC(O1)C(=O)O)C MCULE-8209803482 [0,2,0,0,0,0|2,0,0]=4 5477 B11R1.730 O=C(O)C1CC(CCN1)(F)F MCULE-2772004848 [0,2,0,0,0,0|2,0,0]=4 5478 B11R1.730 O=C(O)C1CC(CCN1)(F)F MCULE-5000214371 [0,2,0,0,0,0|2,0,0]=4 5479 B11R1.730 O=C(O)C1CCCC(C1)(F)F MCULE-2685730195 [0,2,0,0,0,0|1,0,0]=3 5480 B11R1.730 O=C(O)C1CCCS(=O)(=O)C1 MCULE-2941931058 [0,2,0,0,0,0|1,0,0]=3 5481 B11R1.730 O=C(O)C1CNCC(C1)(F)F MCULE-1061763206 [0,2,0,0,0,0|0,0,0]=2 5482 B11R1.730 O=C(O)C1CNCC(C1)(F)F MCULE-4420284602 [0,2,0,0,0,0|0,0,0]=2 5483 B11R1.730 O=C(O)C1CS(=O)(=O)CCN1 MCULE-5588278992 [0,2,0,0,0,0|2,0,0]=4 5484 B11R1.730 O=C(O)C1CS(=O)(=O)CCN1 MCULE-6421455090 [0,2,0,0,0,0|2,0,0]=4 5485 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-1496564772 [0,2,0,0,0,0|2,0,0]=4 5486 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-5121648329 [0,2,0,0,0,0|2,0,0]=4 5487 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-5853696607 [0,2,0,0,0,0|2,0,0]=4 5488 B11R1.730 O=C(O)[C@@H]1CC(CCN1)(F)F MCULE-8207836720 [0,2,0,0,0,0|2,0,0]=4 5489 B11R1.1074 CCC1(CCCCC1)C(=O)O MCULE-1239882099 [0,2,0,0,0,0|1,0,0]=3 5490 B11R1.1074 CCC1(CCCCN1)C(=O)O MCULE-3363810836 [0,2,0,0,0,0|2,0,0]=4 5491 B11R1.1074 CCC1(CCCCN1)C(=O)O MCULE-3511835420 [0,2,0,0,0,0|2,0,0]=4 5492 B11R1.1074 CCC1(CCCNC1)C(=O)N MCULE-1504498322 [0,2,0,0,0,0|1,0,0]=3 5493 B11R1.1074 CCC1(CCCNC1)C(=O)N MCULE-3364775133 [0,2,0,0,0,0|1,0,0]=3 5494 B11R1.1074 CCC1(CCCNC1)C(=O)O MCULE-4082709895 [0,2,0,0,0,0|0,0,0]=2 5495 B11R1.1074 CCC1(CCCNC1)C(=O)O MCULE-4330535403 [0,2,0,0,0,0|0,0,0]=2 5496 B11R1.1074 CCC1(CCNCC1)C(=O)O MCULE-1398986416 [0,2,0,0,0,0|2,0,0]=4 5497 B11R1.1074 CCC1(CCNCC1)C(=O)O MCULE-8638291608 [0,2,0,0,0,0|2,0,0]=4 5498 B11R1.1074 CCC1(CCOCC1)C(=O)O MCULE-8667730132 [0,2,0,0,0,0|2,0,0]=4 5499 B11R1.1074 CCC1(COCCN1)C(=O)O MCULE-7441313827 [0,2,0,0,0,0|2,0,0]=4 5500 B11R1.1074 CCC1(COCOC1)C(=O)O MCULE-8515251768 [0,2,0,0,0,0|2,0,0]=4 5501 B11R1.1074 CNC1(CCCCC1)C(=O)O MCULE-7399184595 [0,2,0,0,0,0|1,0,0]=3 5502 B11R1.1074 CNC1(CCOCC1)C(=O)O MCULE-3359408926 [0,2,0,0,0,0|2,0,0]=4 5503 B11R1.1074 CNC1(CCOCC1)C(=O)O MCULE-4436067730 [0,2,0,0,0,0|2,0,0]=4 5504 B11R1.1074 CNC1(CCSCC1)C(=O)O MCULE-5303303431 [0,2,0,0,0,0|2,0,0]=4 5505 B11R1.1074 COC1(CCCCC1)C(=O)C MCULE-4191142379 [0,2,0,0,0,0|2,0,0]=4 5506 B11R1.1074 COC1(CCCCC1)C(=O)O MCULE-1591494554 [0,2,0,0,0,0|1,0,0]=3 5507 B11R1.1074 COC1(CCCNC1)C(=O)O MCULE-7763705716 [0,2,0,0,0,0|0,0,0]=2 5508 B11R1.1074 COC1(CCCNC1)C(=O)O MCULE-9595367468 [0,2,0,0,0,0|0,0,0]=2 5509 B11R1.1074 COC1(CCNCC1)C(=O)O MCULE-1300106015 [0,2,0,0,0,0|2,0,0]=4 5510 B11R1.1074 COC1(CCNCC1)C(=O)O MCULE-7196776076 [0,2,0,0,0,0|2,0,0]=4 5511 B11R1.1074 COC1(CCOCC1)C(=O)O MCULE-1535370902 [0,2,0,0,0,0|2,0,0]=4 5512 B11R1.1074 N#CC1(CCCCC1)C(=O)O MCULE-2346110250 [0,2,0,0,0,0|1,0,0]=3 5513 B11R1.1074 N#CC1(CCCOC1)C(=O)O MCULE-2226541127 [0,2,0,0,0,0|1,0,0]=3 5514 B11R1.1074 N#CC1(CCNCC1)C(=O)O MCULE-7981587223 [0,2,0,0,0,0|2,0,0]=4 5515 B11R1.1074 N#CC1(CCNCC1)C(=O)O MCULE-8603071721 [0,2,0,0,0,0|2,0,0]=4 5516 B11R1.1074 N#CC1(CCOCC1)C(=O)O MCULE-1172521926 [0,2,0,0,0,0|2,0,0]=4 5517 B11R1.1074 N#CC1(CCSCC1)C(=O)O MCULE-3118110353 [0,2,0,0,0,0|2,0,0]=4 5518 B11R1.1074 NCC1(CCCCC1)C(=O)O MCULE-6540997661 [0,2,0,0,0,0|1,0,0]=3 5519 B11R1.1074 NCC1(CCCCC1)C(=O)O MCULE-8691521129 [0,2,0,0,0,0|1,0,0]=3 5520 B11R1.1074 NCC1(CCCOC1)C(=O)O MCULE-1802610214 [0,2,0,0,0,0|1,0,0]=3 5521 B11R1.1074 NCC1(CCCOC1)C(=O)O MCULE-5207801423 [0,2,0,0,0,0|1,0,0]=3 5522 B11R1.1074 NCC1(CCOCC1)C(=O)O MCULE-3943984495 [0,2,0,0,0,0|2,0,0]=4 5523 B11R1.1074 NCC1(CCOCC1)C(=O)O MCULE-4788693444 [0,2,0,0,0,0|2,0,0]=4 5524 B11R1.1074 O=C(O)C1(CCCCC1)CO MCULE-2836039300 [0,2,0,0,0,0|1,0,0]=3 5525 B11R1.1074 O=C(O)C1(CCOCC1)CF MCULE-8551611962 [0,2,0,0,0,0|2,0,0]=4 5526 B11R1.1074 O=C(O)C1(CCOCC1)CO MCULE-6309166747 [0,2,0,0,0,0|2,0,0]=4 5527 B9R1.7 CCCC1CCC(=O)C1 MCULE-9793680877 [0,0,1,1,0,0|2,0,0]=4 5528 B9R1.7 CCCC1CCC(=O)O1 MCULE-7682573247 [0,0,1,1,0,0|1,0,0]=3 5529 B9R1.7 CCCC1COC(=O)O1 MCULE-7663556618 [0,0,1,1,0,0|2,0,0]=4 5530 B9R1.7 CNCC1CCC(=O)N1 MCULE-3081580104 [0,0,1,1,0,0|1,0,0]=3 5531 B9R1.7 CNC[C@@H]1CCC(=O)N1 MCULE-2568268658 [0,0,1,1,0,0|1,0,0]=3 5532 B9R1.7 CNC[C@@H]1CCC(=O)N1 MCULE-3483815914 [0,0,1,1,0,0|1,0,0]=3 5533 B9R1.7 COCC1CCC(=O)C1 MCULE-5327398944 [0,0,1,1,0,0|2,0,0]=4 5534 B9R1.7 COCC1COC(=O)O1 MCULE-4488263909 [0,0,1,1,0,0|2,0,0]=4 5535 B9R1.7 COC[C@@H]1COC(=O)O1 MCULE-4803003402 [0,0,1,1,0,0|2,0,0]=4 5536 B9R1.7 COC[C@@H]1COC(=O)O1 MCULE-7896550849 [0,0,1,1,0,0|2,0,0]=4 5537 B9R1.7 COC[C@H]1CNC(=O)O1 MCULE-1001119582 [0,0,1,1,0,0|2,0,0]=4 5538 B9R1.7 COC[C@H]1COC(=O)O1 MCULE-4532523996 [0,0,1,1,0,0|2,0,0]=4 5539 B9R1.7 COC[C@H]1COC(=O)O1 MCULE-4644835151 [0,0,1,1,0,0|2,0,0]=4 5540 B9R1.13 C1(CCCN1)CC(=O)O MCULE-3743402418 [0,0,1,1,0,0|0,0,0]=2 5541 B9R1.13 C1(CCCN1)CC(=O)O MCULE-9966702869 [0,0,1,1,0,0|0,0,0]=2 5542 B9R1.13 C1(CCNC1)CC(=O)O MCULE-7279534621 [0,0,1,1,0,0|0,0,0]=2 5543 B9R1.13 C1(CCNC1)NC(=O)C MCULE-3187971747 [0,0,1,1,0,0|2,0,0]=4 5544 B9R1.13 C1(CCNC1)NC(=O)C MCULE-5477008391 [0,0,1,1,0,0|2,0,0]=4 5545 B9R1.13 CC(=O)CC1CCCC1 MCULE-5830536761 [0,0,1,1,0,0|2,0,0]=4 5546 B9R1.13 CC(=O)CC1CCCO1 MCULE-7012539509 [0,0,1,1,0,0|2,0,0]=4 5547 B9R1.13 CC(=O)CC1CCOC1 MCULE-2391008206 [0,0,1,1,0,0|2,0,0]=4 5548 B9R1.13 CC(=O)NC1CCNC1 MCULE-7740912446 [0,0,1,1,0,0|2,0,0]=4 5549 B9R1.13 CC(=O)NC1CCNC1 MCULE-9319017541 [0,0,1,1,0,0|2,0,0]=4 5550 B9R1.13 CC(=O)N[C@@H]1CCNC1 MCULE-1207025314 [0,0,1,1,0,0|2,0,0]=4 5551 B9R1.13 CC(=O)N[C@@H]1CCNC1 MCULE-7984936811 [0,0,1,1,0,0|2,0,0]=4 5552 B9R1.13 CC(=O)N[C@@H]1CCNC1 MCULE-8722694369 [0,0,1,1,0,0|2,0,0]=4 5553 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-3447488838 [0,0,1,1,0,0|2,0,0]=4 5554 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-4093097100 [0,0,1,1,0,0|2,0,0]=4 5555 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-4416464509 [0,0,1,1,0,0|2,0,0]=4 5556 B9R1.13 CC(=O)N[C@H]1CCNC1 MCULE-5561268178 [0,0,1,1,0,0|2,0,0]=4 5557 B9R1.13 CC(=O)OC1CCNC1 MCULE-3149020197 [0,0,1,1,0,0|2,0,0]=4 5558 B9R1.13 CC(=O)OC1CCNC1 MCULE-9159124706 [0,0,1,1,0,0|2,0,0]=4 5559 B9R1.13 CC(O)CC1CCCN1 MCULE-7800705257 [0,0,1,1,0,0|1,0,1]=4 5560 B9R1.13 NC(=O)CC1CCCC1 MCULE-2082339108 [0,0,1,1,0,0|2,0,0]=4 5561 B9R1.13 NC(=O)CC1CCCN1 MCULE-2142594957 [0,0,1,1,0,0|1,0,0]=3 5562 B9R1.13 NC(=O)CC1CCCN1 MCULE-8011902334 [0,0,1,1,0,0|1,0,0]=3 5563 B9R1.13 NC(=O)CC1CCNC1 MCULE-7856346382 [0,0,1,1,0,0|1,0,0]=3 5564 B9R1.13 NC(=O)CC1CCNC1 MCULE-9708437402 [0,0,1,1,0,0|1,0,0]=3 5565 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-2790931086 [0,0,1,1,0,0|1,0,0]=3 5566 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3723741843 [0,0,1,1,0,0|1,0,0]=3 5567 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3877903747 [0,0,1,1,0,0|1,0,0]=3 5568 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-5587287647 [0,0,1,1,0,0|1,0,0]=3 5569 B9R1.13 O=C(Cl)CC1CCCC1 MCULE-1532102571 [0,0,1,1,0,0|2,0,0]=4 5570 B9R1.13 O=C(Cl)CC1CCCO1 MCULE-6649417514 [0,0,1,1,0,0|2,0,0]=4 5571 B9R1.13 O=C(O)/C=C\1/CCNC1 MCULE-3459034443 [0,0,1,1,0,0|0,0,2]=4 5572 B9R1.13 O=C(O)CC1=CCCC1 MCULE-5115478269 [0,0,1,1,0,0|1,0,1]=4 5573 B9R1.13 O=C(O)CC1C=CCC1 MCULE-6825390000 [0,0,1,1,0,0|1,0,1]=4 5574 B9R1.13 O=C(O)CC1CC=CC1 MCULE-8417475923 [0,0,1,1,0,0|1,0,1]=4 5575 B9R1.13 O=C(O)CC1CCCC1 MCULE-1115751804 [0,0,1,1,0,0|1,0,0]=3 5576 B9R1.13 O=C(O)CC1CCCN1 MCULE-6784535537 [0,0,1,1,0,0|0,0,0]=2 5577 B9R1.13 O=C(O)CC1CCCN1 MCULE-8302150253 [0,0,1,1,0,0|0,0,0]=2 5578 B9R1.13 O=C(O)CC1CCCO1 MCULE-8027346350 [0,0,1,1,0,0|1,0,0]=3 5579 B9R1.13 O=C(O)CC1CCNC1 MCULE-3199492917 [0,0,1,1,0,0|0,0,0]=2 5580 B9R1.13 O=C(O)CC1CCNC1 MCULE-3887627276 [0,0,1,1,0,0|0,0,0]=2 5581 B9R1.13 O=C(O)CC1CCOC1 MCULE-5167901709 [0,0,1,1,0,0|1,0,0]=3 5582 B9R1.13 O=C(O)CC1CCOC1 MCULE-9171332464 [0,0,1,1,0,0|1,0,0]=3 5583 B9R1.13 O=C(O)CC1CCSS1 MCULE-4893716992 [0,0,1,1,0,0|2,0,0]=4 5584 B9R1.13 O=C(O)CC1OCCO1 MCULE-2253063465 [0,0,1,1,0,0|2,0,0]=4 5585 B9R1.13 O=C(O)CN1CCCC1 MCULE-3979513963 [0,0,1,1,0,0|2,0,0]=4 5586 B9R1.13 O=C(O)CN1CCCC1 MCULE-4046939568 [0,0,1,1,0,0|2,0,0]=4 5587 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-3034711788 [0,0,1,1,0,0|0,0,0]=2 5588 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-8632270998 [0,0,1,1,0,0|0,0,0]=2 5589 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-9053746158 [0,0,1,1,0,0|0,0,0]=2 5590 B9R1.13 O=C(O)C[C@@H]1CCCO1 MCULE-6652130024 [0,0,1,1,0,0|1,0,0]=3 5591 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-1313399028 [0,0,1,1,0,0|0,0,0]=2 5592 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-3013411353 [0,0,1,1,0,0|0,0,0]=2 5593 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4082052328 [0,0,1,1,0,0|0,0,0]=2 5594 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4709831049 [0,0,1,1,0,0|0,0,0]=2 5595 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-2630690308 [0,0,1,1,0,0|1,0,0]=3 5596 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-6148582776 [0,0,1,1,0,0|1,0,0]=3 5597 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-1934097379 [0,0,1,1,0,0|0,0,0]=2 5598 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-3129569449 [0,0,1,1,0,0|0,0,0]=2 5599 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-8499782890 [0,0,1,1,0,0|0,0,0]=2 5600 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-9712071738 [0,0,1,1,0,0|0,0,0]=2 5601 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-3712345326 [0,0,1,1,0,0|0,0,0]=2 5602 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-4882389427 [0,0,1,1,0,0|0,0,0]=2 5603 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-5390328422 [0,0,1,1,0,0|0,0,0]=2 5604 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-8402835022 [0,0,1,1,0,0|0,0,0]=2 5605 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-3521696581 [0,0,1,1,0,0|1,0,0]=3 5606 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-6096956796 [0,0,1,1,0,0|1,0,0]=3 5607 B9R1.13 [C@H]1(CCCN1)CC(=O)O MCULE-6368276149 [0,0,1,1,0,0|0,0,0]=2 5608 B9R1.40 CC1CNCCC1(C)O MCULE-3050558506 [0,0,1,1,0,0|1,0,1]=4 5609 B9R1.40 CC1CNCCC1(C)O MCULE-7122670765 [0,0,1,1,0,0|1,0,1]=4 5610 B9R1.40 CC1CNCCS1(=O)=O MCULE-1716821348 [0,0,1,1,0,0|1,0,1]=4 5611 B9R1.40 CC1CNCCS1(=O)=O MCULE-4301925241 [0,0,1,1,0,0|1,0,1]=4 5612 B9R1.48 CC1=CC(=O)CCCC1 MCULE-5466118884 [0,0,1,1,0,0|2,0,0]=4 5613 B9R1.48 CC1CCCCC(=O)C1 MCULE-5791948972 [0,0,1,1,0,0|2,0,0]=4 5614 B9R1.48 CC1CCCCC(=O)N1 MCULE-8985894348 [0,0,1,1,0,0|2,0,0]=4 5615 B9R1.48 CC1CNCCC(=O)N1 MCULE-3663408616 [0,0,1,1,0,0|1,0,0]=3 5616 B9R1.48 CC1CNCCS(=O)C1 MCULE-4138647352 [0,0,1,1,0,0|2,0,0]=4 5617 B9R1.48 CC1CNCCS(=O)C1 MCULE-4597207487 [0,0,1,1,0,0|2,0,0]=4 5618 B9R1.48 CN1CCCNC(=O)C1 MCULE-9846049599 [0,0,1,1,0,0|2,0,0]=4 5619 B9R1.48 O=C1CCCCC(=O)O1 MCULE-7893102377 [0,0,1,1,0,0|2,0,0]=4 5620 B9R1.50 O=C1CCCCCCC1 MCULE-1352803313 [0,0,1,1,0,0|2,0,0]=4 5621 B9R1.50 O=C1CCCCCCN1 MCULE-4051743080 [0,0,1,1,0,0|2,0,0]=4 5622 B9R1.50 O=C1CCCCCCO1 MCULE-5149380112 [0,0,1,1,0,0|1,0,0]=3 5623 B9R1.50 O=C1CCNCCCN1 MCULE-8530271368 [0,0,1,1,0,0|1,0,0]=3 5624 B9R1.50 O=C1CCNCCCN1 MCULE-9622115909 [0,0,1,1,0,0|1,0,0]=3 5625 B9R1.59 CCCC1CC1C(=O)O MCULE-5011491615 [0,0,1,1,0,0|1,0,0]=3 5626 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O MCULE-8208745989 [0,0,1,1,0,0|1,0,0]=3 5627 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O MCULE-1448060038 [0,0,1,1,0,0|1,0,0]=3 5628 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O MCULE-6634735984 [0,0,1,1,0,0|1,0,0]=3 5629 B9R1.59 CCOC1CC1C(=O)O MCULE-2083001018 [0,0,1,1,0,0|2,0,0]=4 5630 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O MCULE-4372225112 [0,0,1,1,0,0|2,0,0]=4 5631 B9R1.59 CCO[C@H]1C[C@@H]1C(=O)O MCULE-5085446325 [0,0,1,1,0,0|2,0,0]=4 5632 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O MCULE-9183962958 [0,0,1,1,0,0|1,0,0]=3 5633 B9R1.84 CC(=O)NCC1CNC1 MCULE-2902079896 [0,0,1,1,0,0|2,0,0]=4 5634 B9R1.84 CC(=O)NCC1CNC1 MCULE-8064528419 [0,0,1,1,0,0|2,0,0]=4 5635 B9R1.84 O=C(O)CCC1CCC1 MCULE-5780532364 [0,0,1,1,0,0|1,0,0]=3 5636 B9R1.84 O=C(O)CCN1CCC1 MCULE-6537917818 [0,0,1,1,0,0|0,0,0]=2 5637 B9R1.84 O=C(O)CNC1CCC1 MCULE-3999560243 [0,0,1,1,0,0|2,0,0]=4 5638 B9R1.84 O=C(O)CNC1COC1 MCULE-3211874256 [0,0,1,1,0,0|2,0,0]=4 5639 B9R1.84 O=C(O)CNC1COC1 MCULE-8317257994 [0,0,1,1,0,0|2,0,0]=4 5640 B9R1.84 O=C(O)COC1CCC1 MCULE-3354883487 [0,0,1,1,0,0|2,0,0]=4 5641 B9R1.84 O=C(O)COC1CNC1 MCULE-6412418210 [0,0,1,1,0,0|1,0,0]=3 5642 B9R1.84 O=C([O-])CCN1CCC1 MCULE-8406428888 [0,0,1,1,0,0|0,0,1]=3 5643 B9R1.85 O=C(O)C=CNC1CC1 MCULE-9239525404 [0,0,1,1,0,0|0,0,2]=4 5644 B9R1.85 O=C(O)CCCC1CC1 MCULE-4019156455 [0,0,1,1,0,0|1,0,0]=3 5645 B9R1.85 O=C(O)CCNC1CC1 MCULE-2302148090 [0,0,1,1,0,0|0,0,0]=2 5646 B9R1.85 O=C(O)CCNC1CC1 MCULE-5027011962 [0,0,1,1,0,0|0,0,0]=2 5647 B9R1.85 O=C(O)CCOC1CC1 MCULE-6940104376 [0,0,1,1,0,0|1,0,0]=3 5648 B9R1.85 O=C(O)CCSC1CC1 MCULE-5319803876 [0,0,1,1,0,0|1,0,0]=3 5649 B9R1.85 O=C(O)CNCC1CC1 MCULE-2914571109 [0,0,1,1,0,0|2,0,0]=4 5650 B9R1.85 O=C(O)CNCC1CC1 MCULE-8479764724 [0,0,1,1,0,0|2,0,0]=4 5651 B9R1.85 O=C(O)COCC1CC1 MCULE-1838251623 [0,0,1,1,0,0|2,0,0]=4 5652 B9R1.85 O=C(O)CSCC1CC1 MCULE-7765855577 [0,0,1,1,0,0|2,0,0]=4 5653 B9R1.86 CCC1CC1CC(=O)O MCULE-9659162510 [0,0,1,1,0,0|1,0,0]=3 5654 B9R1.96 C1(NCC1CC)C(=O)O MCULE-9517338987 [0,0,1,1,0,0|2,0,0]=4 5655 B9R1.96 CCC1CNC1C(=O)O MCULE-5561702986 [0,0,1,1,0,0|2,0,0]=4 5656 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-1585063492 [0,0,1,1,0,0|2,0,0]=4 5657 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-7143773936 [0,0,1,1,0,0|2,0,0]=4 5658 B9R1.96 CCN1CCC1C(=O)O MCULE-9616158921 [0,0,1,1,0,0|2,0,0]=4 5659 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-1971461514 [0,0,1,1,0,0|2,0,0]=4 5660 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-4762142431 [0,0,1,1,0,0|2,0,0]=4 5661 B9R1.96 N#CC1CCC1C(=O)O MCULE-1939970378 [0,0,1,1,0,0|2,0,0]=4 5662 B9R1.96 O=C(O)C1CCC1CO MCULE-9648982851 [0,0,1,1,0,0|2,0,0]=4 5663 B9R1.148 CC1(CCCCNC1)O MCULE-3442956887 [0,0,1,1,0,0|1,0,1]=4 5664 B9R1.148 CC1(CCCCNC1)O MCULE-8578810557 [0,0,1,1,0,0|1,0,1]=4 5665 B9R1.148 CC1(CCCNCC1)O MCULE-5871089190 [0,0,1,1,0,0|1,0,1]=4 5666 B9R1.148 CC1(CCCNCC1)O MCULE-9618304213 [0,0,1,1,0,0|1,0,1]=4 5667 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-2380155794 [0,0,1,1,0,0|1,0,1]=4 5668 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-8167005767 [0,0,1,1,0,0|1,0,1]=4 5669 B9R1.148 O=S1(=O)CCCNCC1 MCULE-5296543655 [0,0,1,1,0,0|1,0,1]=4 5670 B9R1.148 O=S1(=O)CCCNCC1 MCULE-5723876472 [0,0,1,1,0,0|1,0,1]=4 5671 B9R1.148 O=S1(=O)CCCNCC1 MCULE-6386871319 [0,0,1,1,0,0|1,0,1]=4 5672 B9R1.5 CC1CCCCCC1=O MCULE-3737709008 [0,0,1,1,0,0|2,0,0]=4 5673 B9R1.5 CC1CCCCNC1=O MCULE-6519247850 [0,0,1,1,0,0|2,0,0]=4 5674 B9R1.5 CC1CNCCCC1=O MCULE-2991075150 [0,0,1,1,0,0|1,0,0]=3 5675 B9R1.5 CC1CNCCCC1=O MCULE-6909508049 [0,0,1,1,0,0|1,0,0]=3 5676 B9R1.5 CC1CNCCCC1O MCULE-7042298511 [0,0,1,1,0,0|1,0,1]=4 5677 B9R1.5 CC1CNCCCC1O MCULE-8658161534 [0,0,1,1,0,0|1,0,1]=4 5678 B9R1.5 CC1CNCCNC1=O MCULE-2843888618 [0,0,1,1,0,0|1,0,0]=3 5679 B9R1.5 CC1CNCCNC1=O MCULE-9735119039 [0,0,1,1,0,0|1,0,0]=3 5680 B9R1.5 CN1CCCNCC1=O MCULE-4819094676 [0,0,1,1,0,0|2,0,0]=4 5681 B9R1.5 CN1CCCNCC1=O MCULE-6447746902 [0,0,1,1,0,0|2,0,0]=4 5682 B9R1.5 O=C1CCCNCC1F MCULE-2925975058 [0,0,1,1,0,0|2,0,0]=4 5683 B9R1.5 O=C1CCCNCC1F MCULE-8103284018 [0,0,1,1,0,0|2,0,0]=4 5684 B9R1.5 O=C1CNCCCC1F MCULE-6506742195 [0,0,1,1,0,0|2,0,0]=4 5685 B9R1.5 O=C1CNCCCC1F MCULE-9667202528 [0,0,1,1,0,0|2,0,0]=4 5686 B9R1.23 CC1N=C(OC1=O)CN MCULE-6614231962 [0,0,1,1,0,0|1,0,1]=4 5687 B9R1.23 CN1CC(CC1=O)CN MCULE-4610214501 [0,0,1,1,0,0|2,0,0]=4 5688 B9R1.23 CN1CC(CC1=O)CN MCULE-5425833484 [0,0,1,1,0,0|2,0,0]=4 5689 B9R1.23 CN1CC(CC1=O)CN MCULE-7603285273 [0,0,1,1,0,0|2,0,0]=4 5690 B9R1.23 CN1CC(OC1=O)CBr MCULE-4776102856 [0,0,1,1,0,0|2,0,0]=4 5691 B9R1.23 CN1CC(OC1=O)CO MCULE-5538633197 [0,0,1,1,0,0|2,0,0]=4 5692 B9R1.23 CN1C[C@@H](OC1=O)CBr MCULE-3550491195 [0,0,1,1,0,0|2,0,0]=4 5693 B9R1.23 CN1C[C@@H](OC1=O)CO MCULE-4135827262 [0,0,1,1,0,0|2,0,0]=4 5694 B9R1.23 CN1C[C@@H](OC1=O)CO MCULE-4222195719 [0,0,1,1,0,0|2,0,0]=4 5695 B9R1.23 CN1C[C@H](CC1=O)CN MCULE-2488884693 [0,0,1,1,0,0|2,0,0]=4 5696 B9R1.23 CN1C[C@H](CC1=O)CN MCULE-3111089731 [0,0,1,1,0,0|2,0,0]=4 5697 B9R1.23 CN1C[C@H](OC1=O)CN MCULE-1843344905 [0,0,1,1,0,0|1,0,0]=3 5698 B9R1.23 CN1C[C@H](OC1=O)CN MCULE-7113883697 [0,0,1,1,0,0|1,0,0]=3 5699 B9R1.23 CN1C[C@H](OC1=O)CO MCULE-5673899033 [0,0,1,1,0,0|2,0,0]=4 5700 B9R1.23 CN1C[C@H](OC1=O)CO MCULE-7788246551 [0,0,1,1,0,0|2,0,0]=4 5701 B9R1.69 CC1CC(=O)C(CN1)C MCULE-5034091059 [0,0,1,1,0,0|1,0,0]=3 5702 B9R1.69 CC1CC(=O)C(CN1)C MCULE-7684286370 [0,0,1,1,0,0|1,0,0]=3 5703 B9R1.69 CC1CC(C(CN1)C)O MCULE-4236165208 [0,0,1,1,0,0|1,0,1]=4 5704 B9R1.69 CC1CC(C(CN1)C)O MCULE-4276808995 [0,0,1,1,0,0|1,0,1]=4 5705 B9R1.69 CC1CC(C(CN1)C)O MCULE-7662096159 [0,0,1,1,0,0|1,0,1]=4 5706 B9R1.69 CC1CCC(C(=O)C1)C MCULE-1189470004 [0,0,1,1,0,0|2,0,0]=4 5707 B9R1.69 CN1CCC(CC1=O)N MCULE-1615743106 [0,0,1,1,0,0|2,0,0]=4 5708 B9R1.69 CN1CCC(CC1=O)N MCULE-3669689846 [0,0,1,1,0,0|2,0,0]=4 5709 B9R1.69 CN1CCC(CC1=O)N MCULE-9029127990 [0,0,1,1,0,0|2,0,0]=4 5710 B9R1.69 CN1CC[C@@H](CC1=O)N MCULE-2173200677 [0,0,1,1,0,0|2,0,0]=4 5711 B9R1.69 CN1CC[C@@H](CC1=O)N MCULE-2636791104 [0,0,1,1,0,0|2,0,0]=4 5712 B9R1.69 CN1CC[C@@H](CC1=O)N MCULE-5158680305 [0,0,1,1,0,0|2,0,0]=4 5713 B9R1.69 CN1CC[C@H](CC1=O)N MCULE-1652984259 [0,0,1,1,0,0|2,0,0]=4 5714 B9R1.93 CCC1CC1(N)C(=O)O MCULE-5139419329 [0,0,1,1,0,0|2,0,0]=4 5715 B9R1.95 CC(=O)N1CC(C1)CN MCULE-7914814524 [0,0,1,1,0,0|2,0,0]=4 5716 B9R1.95 CC(=O)N1CC(C1)CN MCULE-9875135935 [0,0,1,1,0,0|2,0,0]=4 5717 B9R1.95 CCC1CC(C1)C(=O)O MCULE-4399154195 [0,0,1,1,0,0|1,0,0]=3 5718 B9R1.95 CCC1CC(C1)C(=O)O MCULE-6408590394 [0,0,1,1,0,0|1,0,0]=3 5719 B9R1.95 CCN1CC(C1)C(=O)O MCULE-3132525132 [0,0,1,1,0,0|0,0,0]=2 5720 B9R1.95 CNC1CC(C1)C(=O)O MCULE-1477649750 [0,0,1,1,0,0|2,0,0]=4 5721 B9R1.95 CNC1CC(C1)C(=O)O MCULE-2034598338 [0,0,1,1,0,0|2,0,0]=4 5722 B9R1.95 COC1CC(C1)C(=O)O MCULE-8232247707 [0,0,1,1,0,0|2,0,0]=4 5723 B9R1.95 CO[C@H]1C[C@@H](C1)C(=O)O MCULE-4399635730 [0,0,1,1,0,0|2,0,0]=4 5724 B9R1.95 CO[C@H]1C[C@H](C1)C(=O)O MCULE-1315313306 [0,0,1,1,0,0|2,0,0]=4 5725 B9R1.95 N#CC1CC(C1)C(=O)O MCULE-9043105457 [0,0,1,1,0,0|0,0,2]=4 5726 B9R1.95 NCC1CC(C1)C(=O)O MCULE-5139246766 [0,0,1,1,0,0|0,0,0]=2 5727 B9R1.95 NCC1CC(C1)C(=O)O MCULE-9472863522 [0,0,1,1,0,0|0,0,0]=2 5728 B9R1.95 NC[C@H]1C[C@H](C1)C(=O)O MCULE-5593414975 [0,0,1,1,0,0|0,0,0]=2 5729 B9R1.95 NC[C@H]1C[C@H](C1)C(=O)O MCULE-9152509638 [0,0,1,1,0,0|0,0,0]=2 5730 B9R1.95 O=C(O)C1CC(C1)CBr MCULE-6774883657 [0,0,1,1,0,0|1,0,0]=3 5731 B9R1.95 O=C(O)C1CC(C1)CF MCULE-2946863798 [0,0,1,1,0,0|1,0,0]=3 5732 B9R1.95 O=C(O)C1CC(C1)CO MCULE-8568823768 [0,0,1,1,0,0|1,0,0]=3 5733 B9R1.95 O=C(O)[C@H]1C[C@@H](C1)CO MCULE-5347571520 [0,0,1,1,0,0|1,0,0]=3 5734 B9R1.95 O=C(O)[C@H]1C[C@H](C1)CO MCULE-6623890968 [0,0,1,1,0,0|1,0,0]=3 5735 B9R1.95 O=C([O-])[C@H]1C[C@@H](C1)CO MCULE-8717273234 [0,0,1,1,0,0|1,0,1]=4 5736 B9R1.110 C(N)(C(=O)O)C1CCC1 MCULE-9659994288 [0,0,1,1,0,0|2,0,0]=4 5737 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-1352377374 [0,0,1,1,0,0|1,0,0]=3 5738 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-3278183132 [0,0,1,1,0,0|1,0,0]=3 5739 B9R1.110 CC(C(=O)O)C1CCO1 MCULE-4481804660 [0,0,1,1,0,0|1,0,0]=3 5740 B9R1.110 CC(C(=O)O)C1CNC1 MCULE-3425038216 [0,0,1,1,0,0|2,0,0]=4 5741 B9R1.110 CC(C(=O)O)C1CNC1 MCULE-8368638713 [0,0,1,1,0,0|2,0,0]=4 5742 B9R1.110 CC(C(=O)O)C1COC1 MCULE-1438881074 [0,0,1,1,0,0|2,0,0]=4 5743 B9R1.110 CC(C(=O)O)N1CCC1 MCULE-9923940575 [0,0,1,1,0,0|2,0,0]=4 5744 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-3775442501 [0,0,1,1,0,0|2,0,0]=4 5745 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-4685141546 [0,0,1,1,0,0|2,0,0]=4 5746 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-2214697836 [0,0,1,1,0,0|2,0,0]=4 5747 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-7786634114 [0,0,1,1,0,0|2,0,0]=4 5748 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-8265180180 [0,0,1,1,0,0|2,0,0]=4 5749 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-9469768507 [0,0,1,1,0,0|2,0,0]=4 5750 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-4701147798 [0,0,1,1,0,0|2,0,0]=4 5751 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-5196473423 [0,0,1,1,0,0|2,0,0]=4 5752 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-8882106256 [0,0,1,1,0,0|2,0,0]=4 5753 B9R1.110 O=C(O)C(Br)C1CCC1 MCULE-4353551170 [0,0,1,1,0,0|2,0,0]=4 5754 B9R1.110 O=C(O)C(F)C1CCC1 MCULE-8989287343 [0,0,1,1,0,0|2,0,0]=4 5755 B9R1.110 O=C(O)C(O)C1CCC1 MCULE-8720651836 [0,0,1,1,0,0|2,0,0]=4 5756 B9R1.110 O=C(O)[C@@H](O)C1CCC1 MCULE-7295025986 [0,0,1,1,0,0|2,0,0]=4 5757 B9R1.110 O=C(O)[C@H](O)C1CCC1 MCULE-7776940136 [0,0,1,1,0,0|2,0,0]=4 5758 B9R1.112 CC(CC1CC1)C(=O)O MCULE-6769587353 [0,0,1,1,0,0|1,0,0]=3 5759 B9R1.112 CC(SC1CC1)C(=O)O MCULE-6918133296 [0,0,1,1,0,0|2,0,0]=4 5760 B9R1.112 C[C@H](NC1CC1)C(=O)O MCULE-2919785082 [0,0,1,1,0,0|2,0,0]=4 5761 B9R1.112 C[C@H](NC1CC1)C(=O)O MCULE-4729598853 [0,0,1,1,0,0|2,0,0]=4 5762 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2093088646 [0,0,1,1,0,0|2,0,0]=4 5763 B9R1.112 NC(CC1CC1)C(=O)O MCULE-2184599799 [0,0,1,1,0,0|2,0,0]=4 5764 B9R1.112 NC(CC1CC1)C(=O)O MCULE-6147797529 [0,0,1,1,0,0|2,0,0]=4 5765 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-6048291861 [0,0,1,1,0,0|2,0,0]=4 5766 B9R1.112 N[C@@H](CC1CC1)C(=O)O MCULE-9266785362 [0,0,1,1,0,0|2,0,0]=4 5767 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-5333410932 [0,0,1,1,0,0|2,0,0]=4 5768 B9R1.112 N[C@H](CC1CC1)C(=O)O MCULE-6150609140 [0,0,1,1,0,0|2,0,0]=4 5769 B9R1.112 O=C(O)C(F)CC1CC1 MCULE-2152276709 [0,0,1,1,0,0|2,0,0]=4 5770 B9R1.112 O=C(O)C(O)CC1CC1 MCULE-7898828154 [0,0,1,1,0,0|2,0,0]=4 5771 B9R1.112 O=C(O)[C@H](O)CC1CC1 MCULE-3864076940 [0,0,1,1,0,0|2,0,0]=4 5772 B9R1.112 O=C(O)[C@H](O)CC1CC1 MCULE-5498784709 [0,0,1,1,0,0|2,0,0]=4 5773 B9R1.135 CCOC1CC(=O)C1C MCULE-6272881556 [0,0,1,1,0,0|2,0,0]=4 5774 B9R1.22 CC1CC(C(O1)C)CN MCULE-8332746873 [0,0,1,1,0,0|1,0,1]=4 5775 B9R1.33 CCCC1CCCC1=O MCULE-6186440440 [0,0,1,1,0,0|2,0,0]=4 5776 B9R1.33 CCSC1CCOC1=O MCULE-2036311028 [0,0,1,1,0,0|2,0,0]=4 5777 B9R1.33 CNCC1CCCC1O MCULE-1707127587 [0,0,1,1,0,0|1,0,1]=4 5778 B9R1.33 COCC1CCCC1=O MCULE-9169493233 [0,0,1,1,0,0|2,0,0]=4 5779 B9R1.33 COCC1CCNC1=O MCULE-3659365395 [0,0,1,1,0,0|2,0,0]=4 5780 B9R1.33 O=C1OCCC1CCBr MCULE-8450575724 [0,0,1,1,0,0|2,0,0]=4 5781 B9R1.55 CN1CC(C1=O)C(=O)O MCULE-5592777830 [0,0,1,1,0,0|1,0,1]=4 5782 B9R1.116 CNC(C(=O)O)C1CC1 MCULE-7436139771 [0,0,1,1,0,0|2,0,0]=4 5783 B9R1.116 COC(C(=O)O)C1CC1 MCULE-8084470877 [0,0,1,1,0,0|2,0,0]=4 5784 B9R1.116 NOC(C(=O)O)C1CC1 MCULE-4234133801 [0,0,1,1,0,0|1,0,0]=3 5785 B9R1.116 NOC(C(=O)O)C1CC1 MCULE-8165844235 [0,0,1,1,0,0|1,0,0]=3 5786 B9R1.119 C#CC1(CCC1)C(=O)O MCULE-2021077070 [0,0,1,1,0,0|1,0,1]=4 5787 B9R1.119 CCC1(CCC1)C(=O)O MCULE-8472500117 [0,0,1,1,0,0|1,0,0]=3 5788 B9R1.119 CCC1(CCO1)C(=O)O MCULE-9145728118 [0,0,1,1,0,0|2,0,0]=4 5789 B9R1.119 CCC1(CNC1)C(=O)O MCULE-8053068489 [0,0,1,1,0,0|0,0,0]=2 5790 B9R1.119 CCC1(COC1)C(=O)C MCULE-8523538443 [0,0,1,1,0,0|2,0,0]=4 5791 B9R1.119 CCC1(COC1)C(=O)O MCULE-3962066812 [0,0,1,1,0,0|1,0,0]=3 5792 B9R1.119 CC[C@]1(CCO1)C(=O)O MCULE-5752888055 [0,0,1,1,0,0|2,0,0]=4 5793 B9R1.119 CNC1(CCC1)C(=O)O MCULE-3757495053 [0,0,1,1,0,0|2,0,0]=4 5794 B9R1.119 CNC1(CCC1)C(=O)O MCULE-4024637716 [0,0,1,1,0,0|2,0,0]=4 5795 B9R1.119 CNC1(CNC1)C(=O)N MCULE-8113222638 [0,0,1,1,0,0|2,0,0]=4 5796 B9R1.119 CNC1(CNC1)C(=O)N MCULE-9287185171 [0,0,1,1,0,0|2,0,0]=4 5797 B9R1.119 CNC1(CNC1)C(=O)O MCULE-2429867360 [0,0,1,1,0,0|1,0,0]=3 5798 B9R1.119 CNC1(CNC1)C(=O)O MCULE-6668272665 [0,0,1,1,0,0|1,0,0]=3 5799 B9R1.119 CNC1(COC1)C(=O)O MCULE-5428851378 [0,0,1,1,0,0|2,0,0]=4 5800 B9R1.119 COC1(CCC1)C(=O)O MCULE-5969292821 [0,0,1,1,0,0|2,0,0]=4 5801 B9R1.119 COC1(CNC1)C(=O)O MCULE-2037277700 [0,0,1,1,0,0|1,0,0]=3 5802 B9R1.119 COC1(CNC1)C(=O)O MCULE-8524872732 [0,0,1,1,0,0|1,0,0]=3 5803 B9R1.119 CS(=O)C1(CCC1)CN MCULE-1873403604 [0,0,1,1,0,0|2,0,0]=4 5804 B9R1.119 CSC1(CCC1)C(=O)O MCULE-8804902018 [0,0,1,1,0,0|2,0,0]=4 5805 B9R1.119 N#CC1(CCC1)C(=O)O MCULE-3878444605 [0,0,1,1,0,0|0,0,2]=4 5806 B9R1.119 NC(=O)C1(CCC1)CO MCULE-9946184317 [0,0,1,1,0,0|2,0,0]=4 5807 B9R1.119 NCC1(CCC1)C(=O)N MCULE-9304292524 [0,0,1,1,0,0|1,0,0]=3 5808 B9R1.119 NCC1(CCC1)C(=O)O MCULE-3914754838 [0,0,1,1,0,0|0,0,0]=2 5809 B9R1.119 NCC1(CCC1)C(=O)O MCULE-4280814319 [0,0,1,1,0,0|0,0,0]=2 5810 B9R1.119 O=C(O)C1(CCC1)CBr MCULE-5543146509 [0,0,1,1,0,0|1,0,0]=3 5811 B9R1.119 O=C(O)C1(CCC1)CF MCULE-5485073729 [0,0,1,1,0,0|1,0,0]=3 5812 B9R1.119 O=C(O)C1(CCC1)CO MCULE-3232370055 [0,0,1,1,0,0|1,0,0]=3 5813 B9R1.119 O=C(O)C1(CNC1)CF MCULE-5137140836 [0,0,1,1,0,0|1,0,0]=3 5814 B9R1.119 O=C(O)C1(CNC1)CF MCULE-7308600698 [0,0,1,1,0,0|1,0,0]=3 5815 B9R1.119 O=C(O)C1(COC1)CBr MCULE-4458668966 [0,0,1,1,0,0|2,0,0]=4 5816 B9R1.119 O=C(O)C1(COC1)CF MCULE-2717237905 [0,0,1,1,0,0|2,0,0]=4 5817 B9R1.119 O=C(O)C1(COC1)CO MCULE-8517233263 [0,0,1,1,0,0|2,0,0]=4 5818 B9R1.130 CC1CC1(C#N)C(=O)O MCULE-4083324671 [0,0,1,1,0,0|0,0,2]=4 5819 B9R1.130 CC[C@]1(C[C@@H]1F)C(=O)O MCULE-7765739144 [0,0,1,1,0,0|2,0,0]=4 5820 B9R1.130 CC[C@]1(C[C@H]1F)C(=O)O MCULE-6558255104 [0,0,1,1,0,0|2,0,0]=4 5821 B9R1.130 CC[C@]1(C[C@H]1F)C(=O)O MCULE-9949603359 [0,0,1,1,0,0|2,0,0]=4 5822 B9R1.179 C=CCC1(CC1)C(=O)O MCULE-9984484632 [0,0,1,1,0,0|1,0,1]=4 5823 B9R1.179 CCCC1(CC1)C(=O)O MCULE-3737695448 [0,0,1,1,0,0|1,0,0]=3 5824 B9R1.179 CCOC1(CC1)C(=O)O MCULE-2011368943 [0,0,1,1,0,0|2,0,0]=4 5825 B9R1.179 CCSC1(CC1)C(=O)O MCULE-1424616643 [0,0,1,1,0,0|2,0,0]=4 5826 B9R1.179 CNCC1(CC1)C(=O)O MCULE-4156653448 [0,0,1,1,0,0|0,0,0]=2 5827 B9R1.179 CNCC1(CC1)C(=O)O MCULE-7565142951 [0,0,1,1,0,0|0,0,0]=2 5828 B9R1.179 COCC1(CC1)C(=O)O MCULE-8440485105 [0,0,1,1,0,0|1,0,0]=3 5829 B9R1.179 N#CCC1(CC1)C(=O)O MCULE-4792635696 [0,0,1,1,0,0|2,0,0]=4 5830 B9R1.179 NCCC1(CC1)C(=O)O MCULE-1732909908 [0,0,1,1,0,0|2,0,0]=4 5831 B9R1.179 NCCC1(CC1)C(=O)O MCULE-7079307522 [0,0,1,1,0,0|2,0,0]=4 5832 B9R1.179 O=C(O)C1(CC1)CCCl MCULE-8895296339 [0,0,1,1,0,0|2,0,0]=4 5833 B9R1.179 O=C(O)C1(CC1)CCF MCULE-7598361699 [0,0,1,1,0,0|2,0,0]=4 5834 B9R1.179 O=C(O)C1(CC1)CCO MCULE-4706234979 [0,0,1,1,0,0|2,0,0]=4 5835 B9R2.24 BrC1C2CCC1NC2 MCULE-9633334883 [1,0,0,1,0,0|1,0,1]=4 5836 B9R2.24 OC1C2CCC1NC2 MCULE-3410343986 [1,0,0,1,0,0|0,0,1]=3 5837 B9R2.24 OC1C2CCC1NC2 MCULE-7793208491 [1,0,0,1,0,0|0,0,1]=3 5838 B9R2.47 O=CC1CC2CC2C1 MCULE-3086245534 [1,0,0,1,0,0|1,0,0]=3 5839 B9R2.49 C12CCC(CC1)NC2 MCULE-5378947956 [1,0,0,1,0,0|1,0,1]=4 5840 B9R2.49 C1=CC2CCC1CN2 MCULE-8657626482 [1,0,0,1,0,0|1,0,0]=3 5841 B9R2.49 C1=CC2CCC1CN2 MCULE-9900336887 [1,0,0,1,0,0|1,0,0]=3 5842 B9R2.49 C1=CC2CCC1NO2 MCULE-5517632261 [1,0,0,1,0,0|2,0,0]=4 5843 B9R2.49 C1=CC2CCC1NO2 MCULE-9375320805 [1,0,0,1,0,0|2,0,0]=4 5844 B9R2.49 C1CC2CCC1CN2 MCULE-1608637741 [1,0,0,1,0,0|1,0,1]=4 5845 B9R2.49 C1CC2CCC1CN2 MCULE-7057871790 [1,0,0,1,0,0|1,0,1]=4 5846 B9R2.49 C1CC2CCC1NO2 MCULE-4140193508 [1,0,0,1,0,0|2,0,0]=4 5847 B9R2.49 C1CC2CCC1NO2 MCULE-8213101233 [1,0,0,1,0,0|2,0,0]=4 5848 B9R2.49 C1CC2CNC1CN2 MCULE-3482699463 [1,0,0,1,0,0|2,0,0]=4 5849 B9R2.49 C1CC2CNC1CN2 MCULE-6647994953 [1,0,0,1,0,0|2,0,0]=4 5850 B9R2.49 C1CC2CNC1CO2 MCULE-3206976699 [1,0,0,1,0,0|2,0,0]=4 5851 B9R2.49 C1CC2CNC1CO2 MCULE-7670526515 [1,0,0,1,0,0|2,0,0]=4 5852 B9R2.49 C1CC2CNC1CO2 MCULE-8543856318 [1,0,0,1,0,0|2,0,0]=4 5853 B9R2.49 C1C[C@@H]2CN[C@H]1CN2 MCULE-3835733951 [1,0,0,1,0,0|2,0,0]=4 5854 B9R2.49 C1C[C@@H]2CN[C@H]1CO2 MCULE-2948541450 [1,0,0,1,0,0|2,0,0]=4 5855 B9R2.49 C1C[C@@H]2CN[C@H]1CO2 MCULE-7453970603 [1,0,0,1,0,0|2,0,0]=4 5856 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-3527188077 [1,0,0,1,0,0|2,0,0]=4 5857 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-4776793272 [1,0,0,1,0,0|2,0,0]=4 5858 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-7279586694 [1,0,0,1,0,0|2,0,0]=4 5859 B9R2.49 C1C[C@H]2CN[C@@H]1CO2 MCULE-7746905535 [1,0,0,1,0,0|2,0,0]=4 5860 B9R2.49 [C@@H]12CC[C@@H](CN1)NC2 MCULE-2373259985 [1,0,0,1,0,0|2,0,0]=4 5861 B9R2.49 [C@@H]12CC[C@@H](CN1)OC2 MCULE-1116503015 [1,0,0,1,0,0|2,0,0]=4 5862 B9R2.49 [C@H]12CC[C@H](CN1)NC2 MCULE-7729828200 [1,0,0,1,0,0|2,0,0]=4 5863 B9R2.49 [C@H]12CC[C@H](CN1)OC2 MCULE-2654811800 [1,0,0,1,0,0|2,0,0]=4 5864 B9R2.49 [C@H]12CC[C@H](CN1)OC2 MCULE-3318924162 [1,0,0,1,0,0|2,0,0]=4 5865 B9R2.50 C1CNC2CNC2C1 MCULE-1682568819 [1,0,0,1,0,0|2,0,0]=4 5866 B9R2.53 CN1C2CNCC1C2 MCULE-9241612255 [1,0,0,1,0,0|2,0,0]=4 5867 B9R2.53 CN1C2CNCC1C2 MCULE-9444287799 [1,0,0,1,0,0|2,0,0]=4 5868 B9R2.53 O=C1C2CNCC1C2 MCULE-6394567880 [1,0,0,1,0,0|0,0,0]=2 5869 B9R2.53 O=C1C2CNCC1C2 MCULE-9844003850 [1,0,0,1,0,0|0,0,0]=2 5870 B9R2.53 OC1C2CNCC1C2 MCULE-3720434836 [1,0,0,1,0,0|0,0,1]=3 5871 B9R2.53 OC1C2CNCC1C2 MCULE-9173593961 [1,0,0,1,0,0|0,0,1]=3 5872 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-4636094600 [1,0,0,1,0,0|0,0,1]=3 5873 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-5175095450 [1,0,0,1,0,0|0,0,1]=3 5874 B9R2.56 CCC12CNCC1C2 MCULE-4892494743 [1,0,0,1,0,0|1,0,1]=4 5875 B9R2.56 CCC12CNCC1C2 MCULE-9372840219 [1,0,0,1,0,0|1,0,1]=4 5876 B9R2.56 CC[C@]12CNC[C@H]1C2 MCULE-6315765450 [1,0,0,1,0,0|1,0,1]=4 5877 B9R2.56 N#CC12CNCC1C2 MCULE-2055639824 [1,0,0,1,0,0|1,0,1]=4 5878 B9R2.56 N#CC12CNCC1C2 MCULE-2749856680 [1,0,0,1,0,0|1,0,1]=4 5879 B9R2.56 N#CC12CNCC1C2 MCULE-6302465841 [1,0,0,1,0,0|1,0,1]=4 5880 B9R2.56 OCC12CNCC1C2 MCULE-2183499557 [1,0,0,1,0,0|0,0,1]=3 5881 B9R2.56 OCC12CNCC1C2 MCULE-9347935345 [1,0,0,1,0,0|0,0,1]=3 5882 B9R2.56 OCC12COCC1C2 MCULE-7115607299 [1,0,0,1,0,0|1,0,1]=4 5883 B9R2.56 OC[C@]12CNC[C@H]1C2 MCULE-3314930374 [1,0,0,1,0,0|0,0,1]=3 5884 B9R2.56 [C@@H]12CNC[C@@]1(C2)CO MCULE-6677000826 [1,0,0,1,0,0|0,0,1]=3 5885 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-3925746673 [1,0,0,1,0,0|1,0,1]=4 5886 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-6112691555 [1,0,0,1,0,0|1,0,1]=4 5887 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-8930198647 [1,0,0,1,0,0|1,0,1]=4 5888 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-9519595251 [1,0,0,1,0,0|1,0,1]=4 5889 B9R2.65 O=CC1C2C1COC2 MCULE-2549807361 [1,0,0,1,0,0|2,0,0]=4 5890 B9R2.65 O=C[C@@H]1[C@@H]2[C@H]1COC2 MCULE-5985723145 [1,0,0,1,0,0|2,0,0]=4 5891 B9R2.65 OCC1C2C1CCC2 MCULE-2478919102 [1,0,0,1,0,0|1,0,1]=4 5892 B9R2.65 OCC1C2C1OCC2 MCULE-4265471603 [1,0,0,1,0,0|1,0,1]=4 5893 B9R2.65 [C@@H]12COC[C@@H]1[C@@H]2C=O MCULE-5705354373 [1,0,0,1,0,0|2,0,0]=4 5894 B9R2.68 C1CC2CNCC1C2 MCULE-4832064037 [1,0,0,1,0,0|1,0,1]=4 5895 B9R2.68 C1CC2CNCC1C2 MCULE-5527128917 [1,0,0,1,0,0|1,0,1]=4 5896 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 MCULE-3223751153 [1,0,0,1,0,0|1,0,1]=4 5897 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 MCULE-9016762675 [1,0,0,1,0,0|1,0,1]=4 5898 B9R2.68 C1NCC2CC1CO2 MCULE-4813815121 [1,0,0,1,0,0|0,0,1]=3 5899 B9R2.68 C1NCC2CC1CO2 MCULE-9557401424 [1,0,0,1,0,0|0,0,1]=3 5900 B9R2.174 C1CCC2(CC1)CO2 MCULE-8052721660 [1,0,0,1,0,0|1,0,1]=4 5901 B9R2.174 C1CNCC2(C1)CC2 MCULE-5445117072 [1,0,0,1,0,0|1,0,1]=4 5902 B9R2.174 C1CNCC2(C1)CC2 MCULE-7383631601 [1,0,0,1,0,0|1,0,1]=4 5903 B9R2.174 C1CNCC2(C1)CO2 MCULE-5050858433 [1,0,0,1,0,0|0,0,1]=3 5904 B9R2.174 C1CNCC2(C1)CO2 MCULE-8571267197 [1,0,0,1,0,0|0,0,1]=3 5905 B9R2.174 C1CNCC2(C1)N=N2 MCULE-7321991156 [1,0,0,1,0,0|2,0,0]=4 5906 B9R2.174 C1CNCC2(C1)N=N2 MCULE-7839436316 [1,0,0,1,0,0|2,0,0]=4 5907 B9R2.174 C1COCC2(C1)CO2 MCULE-9485375628 [1,0,0,1,0,0|1,0,1]=4 5908 B9R2.2 C1CC(CN1)C2CO2 MCULE-3892468008 [0,0,0,1,1,0|1,0,1]=4 5909 B9R2.2 C1CC(CN1)C2CO2 MCULE-7113445961 [0,0,0,1,1,0|1,0,1]=4 5910 B9R2.7 O=C1CC2C1CNC2 MCULE-7088124346 [0,0,0,1,1,0|1,0,0]=3 5911 B9R2.7 O=C1CC2C1CNC2 MCULE-9132894100 [0,0,0,1,1,0|1,0,0]=3 5912 B9R2.7 O=C1CC2C1NCC2 MCULE-5565431334 [0,0,0,1,1,0|1,0,0]=3 5913 B9R2.7 O=C1CC2C1NCC2 MCULE-8877801710 [0,0,0,1,1,0|1,0,0]=3 5914 B9R2.7 O=C1CC2C1OCC2 MCULE-9845403948 [0,0,0,1,1,0|2,0,0]=4 5915 B9R2.7 O=C1C[C@H]2[C@@H]1OCC2 MCULE-7616272357 [0,0,0,1,1,0|2,0,0]=4 5916 B9R2.7 O=C1NC2C1CCC2 MCULE-4665683392 [0,0,0,1,1,0|1,0,0]=3 5917 B9R2.7 O=C1N[C@@H]2[C@H]1CCC2 MCULE-6354748107 [0,0,0,1,1,0|1,0,0]=3 5918 B9R2.7 OC1CC2C1CCN2 MCULE-1875106894 [0,0,0,1,1,0|1,0,1]=4 5919 B9R2.7 OC1CC2C1CCN2 MCULE-5530554744 [0,0,0,1,1,0|1,0,1]=4 5920 B9R2.7 OC1CC2C1CNC2 MCULE-6123020535 [0,0,0,1,1,0|1,0,1]=4 5921 B9R2.7 OC1CC2C1CNC2 MCULE-6145264990 [0,0,0,1,1,0|1,0,1]=4 5922 B9R2.7 OC1CC2C1NCC2 MCULE-1724056091 [0,0,0,1,1,0|1,0,1]=4 5923 B9R2.7 OC1CC2C1NCC2 MCULE-4088023944 [0,0,0,1,1,0|1,0,1]=4 5924 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CCN2 MCULE-5150400350 [0,0,0,1,1,0|1,0,1]=4 5925 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CCN2 MCULE-7322559182 [0,0,0,1,1,0|1,0,1]=4 5926 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-1183667109 [0,0,0,1,1,0|1,0,1]=4 5927 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-2697058127 [0,0,0,1,1,0|1,0,1]=4 5928 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-9205223064 [0,0,0,1,1,0|1,0,1]=4 5929 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-9459444695 [0,0,0,1,1,0|1,0,1]=4 5930 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CCN2 MCULE-2081667277 [0,0,0,1,1,0|1,0,1]=4 5931 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CCN2 MCULE-3236594496 [0,0,0,1,1,0|1,0,1]=4 5932 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CNC2 MCULE-4765047696 [0,0,0,1,1,0|1,0,1]=4 5933 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CNC2 MCULE-8087349478 [0,0,0,1,1,0|1,0,1]=4 5934 B9R2.7 [C@@H]12CCO[C@@H]1C(=O)C2 MCULE-8869936364 [0,0,0,1,1,0|2,0,0]=4 5935 B9R2.7 [C@@H]12CNC[C@@H]1C[C@@H]2O MCULE-2617041228 [0,0,0,1,1,0|1,0,1]=4 5936 B9R2.7 [C@@H]12CNC[C@@H]1C[C@@H]2O MCULE-3794611955 [0,0,0,1,1,0|1,0,1]=4 5937 B9R2.7 [C@@H]12CNC[C@@H]1C[C@H]2O MCULE-8722541506 [0,0,0,1,1,0|1,0,1]=4 5938 B9R2.7 [C@@H]12CNC[C@@H]1C[C@H]2O MCULE-9165377590 [0,0,0,1,1,0|1,0,1]=4 5939 B9R2.7 [C@@H]12CNC[C@@H]1[C@@H](C2)O MCULE-3033237914 [0,0,0,1,1,0|1,0,1]=4 5940 B9R2.7 [C@@H]12CNC[C@@H]1[C@@H](C2)O MCULE-3748787889 [0,0,0,1,1,0|1,0,1]=4 5941 B9R2.7 [C@@H]12C[C@@H]([C@@H]1CCN2)O MCULE-5782413728 [0,0,0,1,1,0|1,0,1]=4 5942 B9R2.7 [C@@H]12C[C@@H]([C@@H]1CCN2)O MCULE-9662765768 [0,0,0,1,1,0|1,0,1]=4 5943 B9R2.7 [C@H]12CCC[C@H]1NC2=O MCULE-8553168635 [0,0,0,1,1,0|1,0,0]=3 5944 B9R2.39 BrC1=CC2CCC1C2 MCULE-1542178097 [0,0,0,1,1,0|2,0,0]=4 5945 B9R2.39 C12CNC(C1)C(=O)O2 MCULE-4651135224 [0,0,0,1,1,0|0,0,0]=2 5946 B9R2.39 O=C1CC2CC1CN2 MCULE-1513637451 [0,0,0,1,1,0|1,0,0]=3 5947 B9R2.39 O=C1CC2CC1CN2 MCULE-8245110165 [0,0,0,1,1,0|1,0,0]=3 5948 B9R2.39 O=C1CC2CCC1C2 MCULE-2467634489 [0,0,0,1,1,0|1,0,0]=3 5949 B9R2.39 O=C1CC2CCC1N2 MCULE-2060564396 [0,0,0,1,1,0|1,0,0]=3 5950 B9R2.39 O=C1CC2CCC1N2 MCULE-3298355504 [0,0,0,1,1,0|1,0,0]=3 5951 B9R2.39 O=C1CC2CCC1O2 MCULE-3122768457 [0,0,0,1,1,0|2,0,0]=4 5952 B9R2.39 O=C1CC2CNC1C2 MCULE-1302527504 [0,0,0,1,1,0|1,0,0]=3 5953 B9R2.39 O=C1CC2CNC1C2 MCULE-3367580397 [0,0,0,1,1,0|1,0,0]=3 5954 B9R2.39 O=C1CN2CCC1C2 MCULE-2930167084 [0,0,0,1,1,0|1,0,0]=3 5955 B9R2.39 O=C1CN2CCC1C2 MCULE-6962814008 [0,0,0,1,1,0|1,0,0]=3 5956 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 MCULE-9992741520 [0,0,0,1,1,0|1,0,0]=3 5957 B9R2.39 O=C1C[C@H]2CC[C@@H]1C2 MCULE-2228698965 [0,0,0,1,1,0|1,0,0]=3 5958 B9R2.39 O=C1NC2CCC1C2 MCULE-2050587567 [0,0,0,1,1,0|1,0,0]=3 5959 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 MCULE-2601085316 [0,0,0,1,1,0|1,0,0]=3 5960 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 MCULE-6049411288 [0,0,0,1,1,0|1,0,0]=3 5961 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 MCULE-7775612507 [0,0,0,1,1,0|1,0,0]=3 5962 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 MCULE-6863863448 [0,0,0,1,1,0|1,0,0]=3 5963 B9R2.39 O=C1OC2CNC1C2 MCULE-1081203973 [0,0,0,1,1,0|0,0,0]=2 5964 B9R2.39 O=C1OC2CNC1C2 MCULE-4715019258 [0,0,0,1,1,0|0,0,0]=2 5965 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-1020161730 [0,0,0,1,1,0|0,0,0]=2 5966 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-3837738406 [0,0,0,1,1,0|0,0,0]=2 5967 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 MCULE-6980885310 [0,0,0,1,1,0|0,0,0]=2 5968 B9R2.39 OC1CC2CC1CN2 MCULE-1326051035 [0,0,0,1,1,0|1,0,1]=4 5969 B9R2.39 OC1CC2CC1CN2 MCULE-9945384104 [0,0,0,1,1,0|1,0,1]=4 5970 B9R2.39 OC1CC2CCC1C2 MCULE-6414891759 [0,0,0,1,1,0|1,0,1]=4 5971 B9R2.39 OC1CC2CCC1N2 MCULE-1605436075 [0,0,0,1,1,0|1,0,1]=4 5972 B9R2.39 OC1CC2CCC1N2 MCULE-1761281414 [0,0,0,1,1,0|1,0,1]=4 5973 B9R2.39 OC1CC2CNC1C2 MCULE-2749316886 [0,0,0,1,1,0|1,0,1]=4 5974 B9R2.39 OC1CC2CNC1C2 MCULE-4966948452 [0,0,0,1,1,0|1,0,1]=4 5975 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 MCULE-9639323400 [0,0,0,1,1,0|1,0,1]=4 5976 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4979276205 [0,0,0,1,1,0|1,0,1]=4 5977 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-3144398733 [0,0,0,1,1,0|1,0,1]=4 5978 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 MCULE-7894832313 [0,0,0,1,1,0|1,0,1]=4 5979 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 MCULE-6890871381 [0,0,0,1,1,0|1,0,1]=4 5980 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 MCULE-9981789594 [0,0,0,1,1,0|1,0,1]=4 5981 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 MCULE-6071426979 [0,0,0,1,1,0|1,0,1]=4 5982 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-1633391346 [0,0,0,1,1,0|1,0,1]=4 5983 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 MCULE-9461548760 [0,0,0,1,1,0|1,0,1]=4 5984 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-1159886921 [0,0,0,1,1,0|1,0,1]=4 5985 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 MCULE-6982071164 [0,0,0,1,1,0|1,0,1]=4 5986 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 MCULE-2620883448 [0,0,0,1,1,0|1,0,1]=4 5987 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 MCULE-8888575594 [0,0,0,1,1,0|1,0,1]=4 5988 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-4495352435 [0,0,0,1,1,0|1,0,1]=4 5989 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 MCULE-6073992216 [0,0,0,1,1,0|1,0,1]=4 5990 B9R2.39 [C@@H]1(C[C@@H]2CC[C@H]1C2)O MCULE-6218681459 [0,0,0,1,1,0|1,0,1]=4 5991 B9R2.39 [C@@H]12C=C([C@@H](C1)CC2)Br MCULE-1979441209 [0,0,0,1,1,0|2,0,0]=4 5992 B9R2.39 [C@@H]12C=C([C@@H](C1)CC2)C MCULE-9983936985 [0,0,0,1,1,0|2,0,0]=4 5993 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-3428651950 [0,0,0,1,1,0|1,0,1]=4 5994 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-5974580174 [0,0,0,1,1,0|1,0,1]=4 5995 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-6305413134 [0,0,0,1,1,0|1,0,1]=4 5996 B9R2.39 [C@@H]12CC[C@@H](N1)[C@@H](C2)O MCULE-7062654568 [0,0,0,1,1,0|1,0,1]=4 5997 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-4291985781 [0,0,0,1,1,0|1,0,1]=4 5998 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](C2)O MCULE-8663774893 [0,0,0,1,1,0|1,0,1]=4 5999 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-4857421267 [0,0,0,1,1,0|0,0,0]=2 6000 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-5314520254 [0,0,0,1,1,0|0,0,0]=2 6001 B9R2.39 [C@@H]12CN[C@@H](C1)C(=O)O2 MCULE-8592680797 [0,0,0,1,1,0|0,0,0]=2 6002 B9R2.39 [C@H]12CCN(C1)CC2=O MCULE-4642920839 [0,0,0,1,1,0|1,0,0]=3 6003 B9R2.39 [C@H]12CCN(C1)C[C@@H]2O MCULE-9304924445 [0,0,0,1,1,0|1,0,1]=4 6004 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 MCULE-3838940137 [0,0,0,1,1,0|1,0,0]=3 6005 B9R2.39 [C@H]12CC[C@H](C1)CC2=O MCULE-1488894938 [0,0,0,1,1,0|1,0,0]=3 6006 B9R2.39 [C@H]12CC[C@H](C1)CC2O MCULE-7175651186 [0,0,0,1,1,0|1,0,1]=4 6007 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-4118507960 [0,0,0,1,1,0|1,0,1]=4 6008 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-9141970579 [0,0,0,1,1,0|1,0,1]=4 6009 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-4746309717 [0,0,0,1,1,0|1,0,1]=4 6010 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-5454625797 [0,0,0,1,1,0|1,0,1]=4 6011 B9R2.148 O=C(O)C1C2C1CC2 MCULE-2273094599 [0,0,0,1,1,0|0,0,0]=2 6012 B9R2.148 O=C(O)C1C2C1NC2 MCULE-5026622210 [0,0,0,1,1,0|0,0,0]=2 6013 B11R2.4 O=C1CN1C2CCCCC2 MCULE-3290999340 [0,0,0,1,0,1|2,0,0]=4 6014 B11R2.10 BrC1=CC2CNCCC2S1 MCULE-7787851205 [0,0,0,1,0,1|1,1,0]=4 6015 B11R2.10 O=C1C=C2CNCCC2S1 MCULE-3124302392 [0,0,0,1,0,1|0,1,1]=4 6016 B11R2.10 O=C1C=C2CNCCC2S1 MCULE-3424771012 [0,0,0,1,0,1|0,1,1]=4 6017 B11R2.10 O=C1C=C2CNCC[C@@H]2S1 MCULE-3073696114 [0,0,0,1,0,1|0,1,1]=4 6018 B11R2.10 O=C1NC2CCNCC2O1 MCULE-5226985806 [0,0,0,1,0,1|1,0,0]=3 6019 B11R2.10 O=C1NC2CCNCC2O1 MCULE-7291987964 [0,0,0,1,0,1|1,0,0]=3 6020 B11R2.10 O=C1NC2CNCCC2O1 MCULE-3220248267 [0,0,0,1,0,1|0,0,0]=2 6021 B11R2.10 O=C1NC2CNCCC2O1 MCULE-8049381990 [0,0,0,1,0,1|0,0,0]=2 6022 B11R2.10 O=C1NC2NCCNC2N1 MCULE-5105119549 [0,0,0,1,0,1|2,0,0]=4 6023 B11R2.10 O=C1N[C@H]2CNCC[C@H]2O1 MCULE-5763487129 [0,0,0,1,0,1|0,0,0]=2 6024 B11R2.10 O=C1N[C@H]2CNCC[C@H]2O1 MCULE-7765284819 [0,0,0,1,0,1|0,0,0]=2 6025 B11R2.10 O=C1OC2CCCCC2O1 MCULE-7459022606 [0,0,0,1,0,1|1,0,0]=3 6026 B11R2.10 [C@@H]12CNCC[C@@H]1CC(=O)N2 MCULE-3161369201 [0,0,0,1,0,1|1,0,0]=3 6027 B11R2.10 [C@@H]12CNCC[C@@H]1CC(=O)N2 MCULE-5515197825 [0,0,0,1,0,1|1,0,0]=3 6028 B11R2.10 [C@H]12CNCC[C@H]1OC(=O)N2 MCULE-8841468329 [0,0,0,1,0,1|0,0,0]=2 6029 B11R2.10 [C@H]12CNCC[C@H]1OC(=O)N2 MCULE-9597858572 [0,0,0,1,0,1|0,0,0]=2 6030 B11R2.433 O=C1CC2CCC(N1)CN2 MCULE-5505959202 [0,0,0,1,0,1|1,0,0]=3 6031 B11R2.433 O=C1CC2CCC(N1)CN2 MCULE-5626978495 [0,0,0,1,0,1|1,0,0]=3 6032 B11R2.678 O=C1CC2CCCC(C1)C2 MCULE-7773766432 [0,0,0,1,0,1|2,0,0]=4 6033 B11R2.678 O=C1CC2CCCN(C1)C2 MCULE-2221110725 [0,0,0,1,0,1|1,0,0]=3 6034 B11R2.678 OC1CC2CNCC(C1)C2 MCULE-1986393942 [0,0,0,1,0,1|1,0,1]=4 6035 B11R2.678 OC1CC2CNCC(C1)C2 MCULE-7652108753 [0,0,0,1,0,1|1,0,1]=4 6036 B11R2.678 [C@H]12CCC[C@H](C1)NC(=O)O2 MCULE-1098666712 [0,0,0,1,0,1|1,0,0]=3 6037 B11R2.678 [C@H]12CCC[C@H](C1)OC(=O)N2 MCULE-2754928602 [0,0,0,1,0,1|1,0,0]=3 6038 B11R2.703 O=C1CC2(C1)CCCCC2 MCULE-1618832241 [0,0,0,1,0,1|2,0,0]=4 6039 B11R2.703 O=C1CC2(C1)CCCNC2 MCULE-7243873915 [0,0,0,1,0,1|1,0,0]=3 6040 B11R2.703 O=C1CC2(C1)CCCNC2 MCULE-9850053819 [0,0,0,1,0,1|1,0,0]=3 6041 B11R2.703 O=C1CC2(N1)CCCCC2 MCULE-2086106260 [0,0,0,1,0,1|2,0,0]=4 6042 B11R2.703 O=C1CC2(N1)CCCNC2 MCULE-8609664830 [0,0,0,1,0,1|1,0,0]=3 6043 B11R2.703 O=C1C[C@@]2(N1)CCCNC2 MCULE-3056977774 [0,0,0,1,0,1|1,0,0]=3 6044 B11R2.824 O=C(O)C1C2CCC1NC2 MCULE-5267201254 [0,0,0,1,0,1|0,0,0]=2 6045 B11R2.824 O=C(O)C1C2CCC1NC2 MCULE-8256228320 [0,0,0,1,0,1|0,0,0]=2 6046 B11R2.824 O=C(O)C1C2CCN1CC2 MCULE-1490891130 [0,0,0,1,0,1|2,0,0]=4 6047 B11R2.824 O=C(O)C1C2CCN1CC2 MCULE-5536299146 [0,0,0,1,0,1|2,0,0]=4 6048 B11R2.824 O=C(O)[C@H]1[C@@H]2CC[C@H]1CN2 MCULE-7339799108 [0,0,0,1,0,1|0,0,0]=2 6049 B11R2.824 O=C(O)[C@H]1[C@@H]2CC[C@H]1CN2 MCULE-9199699839 [0,0,0,1,0,1|0,0,0]=2 6050 B11R2.824 [C@H]12CC[C@H]([C@H]1C(=O)O)CN2 MCULE-3123155349 [0,0,0,1,0,1|0,0,0]=2 6051 B11R2.824 [C@H]12CC[C@H]([C@H]1C(=O)O)CN2 MCULE-3672711458 [0,0,0,1,0,1|0,0,0]=2 6052 B11R2.860 O=C(O)CC1C2C1CNC2 MCULE-1601875469 [0,0,0,1,0,1|2,0,0]=4 6053 B11R2.860 O=C(O)CC1C2C1COC2 MCULE-9894739276 [0,0,0,1,0,1|2,0,0]=4 6054 B11R2.860 [C@@H]12COC[C@@H]1[C@H]2CC(=O)O MCULE-5737043736 [0,0,0,1,0,1|2,0,0]=4 6055 B11R2.932 O=C(O)CC1CCC2C1C2 MCULE-5939746375 [0,0,0,1,0,1|1,0,0]=3 6056 B11R2.1824 CC(=O)N1C2CNCC1C2 MCULE-3279404235 [0,0,0,1,0,1|1,0,0]=3 6057 B11R2.1824 O=C(O)C1C2CNCC1C2 MCULE-3152609545 [0,0,0,1,0,1|0,0,0]=2 6058 B11R2.1824 O=C(O)C1C2CNCC1C2 MCULE-8515280205 [0,0,0,1,0,1|0,0,0]=2 6059 B11R2.1852 O=C(O)C1C2C1CCCC2 MCULE-2502533102 [0,0,0,1,0,1|1,0,0]=3 6060 B11R2.1852 O=C(O)C1C2C1COCC2 MCULE-6954766584 [0,0,0,1,0,1|1,0,0]=3 6061 B11R2.1852 O=C(O)C1C2C1OCCO2 MCULE-7832629497 [0,0,0,1,0,1|2,0,0]=4 6062 B11R2.1852 O=C(O)[C@@H]1[C@@H]2[C@H]1CCCC2 MCULE-2721847322 [0,0,0,1,0,1|1,0,0]=3 6063 B11R2.1852 [C@@H]12COCC[C@@H]1C2C(=O)O MCULE-9430309964 [0,0,0,1,0,1|1,0,0]=3 6064 B11R2.48 O=C1NC2CCC1CNC2 MCULE-2190424917 [0,0,0,1,0,1|1,0,0]=3 6065 B11R2.48 O=C1N[C@H]2CC[C@@H]1CNC2 MCULE-9556211454 [0,0,0,1,0,1|1,0,0]=3 6066 B11R2.48 O=C1OC2C=CCC1CC2 MCULE-6582262450 [0,0,0,1,0,1|1,0,0]=3 6067 B11R2.48 O=C1OC2CCCC1CC2 MCULE-9400840522 [0,0,0,1,0,1|1,0,0]=3 6068 B11R2.48 [C@H]12CC[C@H](CNC1)C(=O)N2 MCULE-1179542442 [0,0,0,1,0,1|1,0,0]=3 6069 B11R2.711 O=C1NC2C1CCCCC2 MCULE-6577332534 [0,0,0,1,0,1|2,0,0]=4 6070 B11R2.813 CC(=O)C12CCCCC1C2 MCULE-6704773068 [0,0,0,1,0,1|2,0,0]=4 6071 B11R2.813 O=C(O)C12CC1CCCN2 MCULE-4247938910 [0,0,0,1,0,1|1,0,0]=3 6072 B11R2.813 O=C(O)C12CC1CCCN2 MCULE-4913986428 [0,0,0,1,0,1|1,0,0]=3 6073 B11R2.813 O=C(O)C12CCCCC1C2 MCULE-8164847486 [0,0,0,1,0,1|1,0,0]=3 6074 B11R2.813 O=C(O)C12CCNCC1C2 MCULE-1960768540 [0,0,0,1,0,1|0,0,0]=2 6075 B11R2.813 O=C(O)C12CCNCC1C2 MCULE-9023292994 [0,0,0,1,0,1|0,0,0]=2 6076 B11R2.813 O=C(O)C12CNCCC1C2 MCULE-3253248385 [0,0,0,1,0,1|0,0,0]=2 6077 B11R2.813 O=C(O)C12CNCCC1C2 MCULE-4328236690 [0,0,0,1,0,1|0,0,0]=2 6078 B11R2.814 O=C(O)C1CC2C1CCC2 MCULE-6814629609 [0,0,0,1,0,1|1,0,0]=3 6079 B11R2.819 O=C(O)C12CCC1CNC2 MCULE-5440576235 [0,0,0,1,0,1|0,0,0]=2 6080 B11R2.819 O=C(O)C12CCC1CNC2 MCULE-7903679300 [0,0,0,1,0,1|0,0,0]=2 6081 B11R2.822 O=C(O)C1NCC2C1CC2 MCULE-1771587431 [0,0,0,1,0,1|1,0,0]=3 6082 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2[C@H]1CC2 MCULE-2762293004 [0,0,0,1,0,1|1,0,0]=3 6083 B11R2.822 O=C(O)[C@@H]1NC[C@@H]2[C@H]1CC2 MCULE-7115056217 [0,0,0,1,0,1|1,0,0]=3 6084 B11R2.822 [C@H]12CC[C@H]1CN[C@@H]2C(=O)O MCULE-5715089354 [0,0,0,1,0,1|1,0,0]=3 6085 B11R2.822 [C@H]12CC[C@H]1CN[C@@H]2C(=O)O MCULE-5720996089 [0,0,0,1,0,1|1,0,0]=3 6086 B11R2.822 [C@H]12CC[C@H]1CN[C@H]2C(=O)O MCULE-6325799801 [0,0,0,1,0,1|1,0,0]=3 6087 B11R2.822 [C@H]12CC[C@H]1CN[C@H]2C(=O)O MCULE-9154008612 [0,0,0,1,0,1|1,0,0]=3 6088 B11R2.839 O=C(O)C1CCC2CC2C1 MCULE-9539219207 [0,0,0,1,0,1|1,0,0]=3 6089 B11R2.842 O=C(O)C1CC2CCC2C1 MCULE-9918842821 [0,0,0,1,0,1|1,0,0]=3 6090 B11R2.1837 O=C(O)C1CCCC2C1C2 MCULE-3545310305 [0,0,0,1,0,1|1,0,0]=3 6091 B11R2.1837 O=C(O)C1NCCC2C1C2 MCULE-7549040679 [0,0,0,1,0,1|1,0,0]=3 6092 B11R2.1837 O=C(O)C1NCCC2C1C2 MCULE-8003320761 [0,0,0,1,0,1|1,0,0]=3 6093 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2[C@@H]1C2 MCULE-5605484677 [0,0,0,1,0,1|1,0,0]=3 6094 B11R2.1837 O=C(O)[C@@H]1NCC[C@H]2[C@@H]1C2 MCULE-8372319730 [0,0,0,1,0,1|1,0,0]=3 6095 B11R2.1837 O=C(O)[C@H]1NCC[C@@H]2[C@H]1C2 MCULE-3959784629 [0,0,0,1,0,1|1,0,0]=3 6096 B11R2.1837 O=C(O)[C@H]1NCC[C@@H]2[C@H]1C2 MCULE-9660720209 [0,0,0,1,0,1|1,0,0]=3 6097 B11R2.1837 O=C(O)[C@H]1NCC[C@H]2[C@@H]1C2 MCULE-2415102953 [0,0,0,1,0,1|1,0,0]=3 6098 B11R2.1837 O=C(O)[C@H]1NCC[C@H]2[C@@H]1C2 MCULE-3447611520 [0,0,0,1,0,1|1,0,0]=3 6099 B11R2.1837 [C@@H]12CCNC([C@@H]1C2)C(=O)O MCULE-1481596159 [0,0,0,1,0,1|1,0,0]=3 6100 B11R2.1837 [C@@H]12CCNC([C@@H]1C2)C(=O)O MCULE-3526088768 [0,0,0,1,0,1|1,0,0]=3 6101 B11R2.1837 [C@H]12CCNC([C@@H]1C2)C(=O)O MCULE-1555944016 [0,0,0,1,0,1|1,0,0]=3 6102 B11R2.1837 [C@H]12CCNC([C@@H]1C2)C(=O)O MCULE-5915776174 [0,0,0,1,0,1|1,0,0]=3 6103 B11R2.1837 [C@H]12CCN[C@H]([C@H]1C2)C(=O)O MCULE-8519514554 [0,0,0,1,0,1|1,0,0]=3 6104 B11R2.1837 [C@H]12CCN[C@H]([C@H]1C2)C(=O)O MCULE-8683744573 [0,0,0,1,0,1|1,0,0]=3 6105 B11R2.64 O=C1NCC2CCC1CN2 MCULE-6014809802 [0,1,0,1,0,0|1,0,0]=3 6106 B11R2.64 O=C1NCC2CCC1CN2 MCULE-6172944585 [0,1,0,1,0,0|1,0,0]=3 6107 B11R2.68 O=C1OC2CC1CCC2Br MCULE-7626914072 [0,1,0,1,0,0|1,0,0]=3 6108 B11R2.68 O=C1O[C@@H]2CC1CC[C@H]2I MCULE-6993806994 [0,1,0,1,0,0|1,0,0]=3 6109 B11R2.564 NC1C2C1CC(C2)C(=O)O MCULE-3977960580 [0,1,0,1,0,0|1,0,0]=3 6110 B11R2.564 NC1C2C1CC(C2)C(=O)O MCULE-6176990589 [0,1,0,1,0,0|1,0,0]=3 6111 B11R2.564 NC1C2C1CC(C2)C(=O)O MCULE-9184232184 [0,1,0,1,0,0|1,0,0]=3 6112 B11R2.700 CN1CC2C(C1)C2C(=O)O MCULE-8340519607 [0,1,0,1,0,0|2,0,0]=4 6113 B11R2.700 CN1CC2C(C1)C2C(=O)O MCULE-8715239850 [0,1,0,1,0,0|2,0,0]=4 6114 B11R2.700 CN1C[C@@H]2[C@@H]([C@@H]2C1)C(=O)O MCULE-9412932062 [0,1,0,1,0,0|2,0,0]=4 6115 B11R2.700 CN1C[C@@H]2[C@@H]([C@@H]2C1)C(=O)O MCULE-9928226454 [0,1,0,1,0,0|2,0,0]=4 6116 B11R2.700 [C@@H]12CN(C[C@@H]1[C@H]2C(=O)O)C MCULE-1261942021 [0,1,0,1,0,0|2,0,0]=4 6117 B11R2.700 [C@@H]12CN(C[C@@H]1[C@H]2C(=O)O)C MCULE-3435071322 [0,1,0,1,0,0|2,0,0]=4 6118 B11R2.821 [C@@H]12CC[C@@H]([C@@H](C1)N2)C(=O)O MCULE-4969323707 [0,1,0,1,0,0|0,0,0]=2 6119 B11R2.1839 NC(=O)C12CCC(C1)CC2 MCULE-2431830147 [0,1,0,1,0,0|2,0,0]=4 6120 B11R2.1839 NC(=O)C12CCC(N1)CC2 MCULE-9139917072 [0,1,0,1,0,0|2,0,0]=4 6121 B11R2.1839 O=C(O)C12C=CC(C1)CC2 MCULE-4960669059 [0,1,0,1,0,0|1,0,1]=4 6122 B11R2.1839 O=C(O)C12CCC(C1)CC2 MCULE-6630732907 [0,1,0,1,0,0|1,0,0]=3 6123 B11R2.1839 O=C(O)C12CCC(C1)CN2 MCULE-5678506531 [0,1,0,1,0,0|2,0,0]=4 6124 B11R2.1839 O=C(O)C12CCC(C1)CN2 MCULE-7284735604 [0,1,0,1,0,0|2,0,0]=4 6125 B11R2.1839 O=C(O)C12CCC(N1)CC2 MCULE-3118230770 [0,1,0,1,0,0|1,0,0]=3 6126 B11R2.1839 O=C(O)C12CCC(N1)CC2 MCULE-9332995177 [0,1,0,1,0,0|1,0,0]=3 6127 B11R2.1839 O=C(O)C12CCC(O1)CC2 MCULE-3125021989 [0,1,0,1,0,0|1,0,0]=3 6128 B11R2.1839 O=C(O)C12CCN(C1)CC2 MCULE-3565766296 [0,1,0,1,0,0|2,0,0]=4 6129 B11R2.1839 O=C(O)C12CCN(C1)CC2 MCULE-9794392710 [0,1,0,1,0,0|2,0,0]=4 6130 B11R2.1839 [C@@H]12CCC(C1)(CN2)C(=O)O MCULE-4354063940 [0,1,0,1,0,0|0,0,0]=2 6131 B11R2.1839 [C@@H]12CCC(C1)(CN2)C(=O)O MCULE-8094375931 [0,1,0,1,0,0|0,0,0]=2 6132 B11R2.1839 [C@H]12CCC(C1)(CN2)C(=O)O MCULE-1269384340 [0,1,0,1,0,0|0,0,0]=2 6133 B11R2.1839 [C@H]12CCC(C1)(CN2)C(=O)O MCULE-9709707983 [0,1,0,1,0,0|0,0,0]=2 6134 B11R2.1 O=C1CCC2C1CCCC2 MCULE-5230213478 [0,1,0,1,0,0|2,0,0]=4 6135 B11R2.1 O=C1CC[C@@H]2[C@H]1CNCC2 MCULE-7693252732 [0,1,0,1,0,0|1,0,0]=3 6136 B11R2.1 O=C1CC[C@@H]2[C@H]1CNCC2 MCULE-9086665591 [0,1,0,1,0,0|1,0,0]=3 6137 B11R2.1 O=C1NCC2C1CCCC2 MCULE-5314216235 [0,1,0,1,0,0|2,0,0]=4 6138 B11R2.1 O=C1NCC2C1CCCN2 MCULE-4264936664 [0,1,0,1,0,0|1,0,0]=3 6139 B11R2.1 O=C1NCC2C1CNCC2 MCULE-6172538166 [0,1,0,1,0,0|1,0,0]=3 6140 B11R2.1 O=C1NOC2=C1CNCC2 MCULE-6242367190 [0,1,0,1,0,0|0,0,2]=4 6141 B11R2.1 O=C1OCC2=C1CCCN2 MCULE-1356191286 [0,1,0,1,0,0|0,0,2]=4 6142 B11R2.1 O=C1OCC2C1CCCC2 MCULE-3625572177 [0,1,0,1,0,0|1,0,0]=3 6143 B11R2.1 O=C1OCC2N1CCCC2 MCULE-7447605306 [0,1,0,1,0,0|2,0,0]=4 6144 B11R2.1 [C@@H]12CCNC[C@@H]1C(=O)NC2 MCULE-2880493380 [0,1,0,1,0,0|1,0,0]=3 6145 B11R2.1 [C@@H]12CCNC[C@@H]1C(=O)NC2 MCULE-4589026986 [0,1,0,1,0,0|1,0,0]=3 6146 B11R2.1 [C@@H]12CCNC[C@@H]1C(=O)NC2 MCULE-9209813333 [0,1,0,1,0,0|1,0,0]=3 6147 B11R2.1 [C@H]12CCCC[C@H]1COC2=O MCULE-7096465884 [0,1,0,1,0,0|1,0,0]=3 6148 B11R2.1 [C@H]12CCNC[C@H]1C(=O)NC2 MCULE-6557117342 [0,1,0,1,0,0|1,0,0]=3 6149 B11R2.1 [C@H]12CCNC[C@H]1C(=O)NC2 MCULE-7866008417 [0,1,0,1,0,0|1,0,0]=3 6150 B11R2.12 O=C1CCC12CCCCC2 MCULE-1472740479 [0,1,0,1,0,0|2,0,0]=4 6151 B11R2.12 O=C1COC12CCCCC2 MCULE-3670246496 [0,1,0,1,0,0|1,0,0]=3 6152 B11R2.12 O=C1NCC12CCCNC2 MCULE-2309975536 [0,1,0,1,0,0|1,0,0]=3 6153 B11R2.12 O=C1NCC12CCCNC2 MCULE-4056738652 [0,1,0,1,0,0|1,0,0]=3 6154 B11R2.12 O=C1NC[C@@]12CCCNC2 MCULE-3023321228 [0,1,0,1,0,0|1,0,0]=3 6155 B11R2.40 OC1(CC1)C2CCCNC2 MCULE-1141696449 [0,1,0,1,0,0|1,0,1]=4 6156 B11R2.40 OC1(CC1)C2CCCNC2 MCULE-3400275280 [0,1,0,1,0,0|1,0,1]=4 6157 B11R2.357 O=C1CCN2CCCC1C2 MCULE-9793314447 [0,1,0,1,0,0|1,0,0]=3 6158 B11R2.367 OC1C2CCC(C1O)NC2 MCULE-3801140254 [0,1,0,1,0,0|0,0,2]=4 6159 B11R2.367 OC1C2CCC(C1O)NC2 MCULE-9126858644 [0,1,0,1,0,0|0,0,2]=4 6160 B11R2.895 COC(=O)C12CC1CCN2 MCULE-2288179679 [0,1,0,1,0,0|2,0,0]=4 6161 B11R2.895 COC(=O)C12CC1CCN2 MCULE-6363503111 [0,1,0,1,0,0|2,0,0]=4 6162 B11R2.895 COC(=O)C12CNCC1C2 MCULE-6203019351 [0,1,0,1,0,0|0,0,0]=2 6163 B11R2.895 COC(=O)C12CNCC1C2 MCULE-8537344219 [0,1,0,1,0,0|0,0,0]=2 6164 B11R2.895 COC(=O)[C@]12CC1CCN2 MCULE-4746558280 [0,1,0,1,0,0|2,0,0]=4 6165 B11R2.895 COC(=O)[C@]12C[C@H]1CCN2 MCULE-5638691203 [0,1,0,1,0,0|2,0,0]=4 6166 B11R2.895 [C@@H]12CCN[C@@]1(C2)C(=O)OC MCULE-1104693029 [0,1,0,1,0,0|2,0,0]=4 6167 B11R2.905 C12CNCC1C2C(=O)OC MCULE-1138187773 [0,1,0,1,0,0|2,0,0]=4 6168 B11R2.905 C12CNCC1C2C(=O)OC MCULE-8347407800 [0,1,0,1,0,0|2,0,0]=4 6169 B11R2.905 COC(=O)[C@H]1[C@@H]2[C@H]1CNC2 MCULE-7708313271 [0,1,0,1,0,0|2,0,0]=4 6170 B11R2.905 [C@@H]12CNC[C@@H]1[C@@H]2C(=O)OC MCULE-1202144892 [0,1,0,1,0,0|2,0,0]=4 6171 B11R2.905 [C@@H]12CNC[C@@H]1[C@H]2C(=O)OC MCULE-5648889546 [0,1,0,1,0,0|2,0,0]=4 6172 B11R2.905 [C@@H]12CNC[C@@H]1[C@H]2C(=O)OC MCULE-7481846013 [0,1,0,1,0,0|2,0,0]=4 6173 B11R2.911 C12CNC(C1C2)C(=O)OC MCULE-1898138848 [0,1,0,1,0,0|2,0,0]=4 6174 B11R2.911 C12CNC(C1C2)C(=O)OC MCULE-2593369815 [0,1,0,1,0,0|2,0,0]=4 6175 B11R2.911 COC(=O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1808508130 [0,1,0,1,0,0|2,0,0]=4 6176 B11R2.911 COC(=O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-8597092683 [0,1,0,1,0,0|2,0,0]=4 6177 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-4678740496 [0,1,0,1,0,0|2,0,0]=4 6178 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-8212632843 [0,1,0,1,0,0|2,0,0]=4 6179 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-8682288025 [0,1,0,1,0,0|2,0,0]=4 6180 B11R2.911 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)OC MCULE-9440290794 [0,1,0,1,0,0|2,0,0]=4 6181 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-1811469529 [0,1,0,1,0,0|2,0,0]=4 6182 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-3154566544 [0,1,0,1,0,0|2,0,0]=4 6183 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-6573688012 [0,1,0,1,0,0|2,0,0]=4 6184 B11R2.911 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)OC MCULE-7961003347 [0,1,0,1,0,0|2,0,0]=4 6185 B11R2.914 COC(=O)C1CC2CC2C1 MCULE-6179800543 [0,1,0,1,0,0|1,0,0]=3 6186 B11R2.914 COC(=O)C1CC2OC2C1 MCULE-5558345645 [0,1,0,1,0,0|2,0,0]=4 6187 B11R2.914 COC(=O)C1C[C@@H]2O[C@H]2C1 MCULE-5139827570 [0,1,0,1,0,0|2,0,0]=4 6188 B11R2.914 [C@H]12C[C@@H](C[C@H]1O2)C(=O)OC MCULE-4497705681 [0,1,0,1,0,0|2,0,0]=4 6189 B11R2.118 O=C1CC2CCC1C(=O)N2 MCULE-9588308992 [0,1,0,1,0,0|1,0,1]=4 6190 B11R2.200 CC12CCCCC1C(=O)N2 MCULE-5779684194 [0,1,0,1,0,0|2,0,0]=4 6191 B11R2.845 C1(CC2CCN1C2)C(=O)O MCULE-3481999924 [0,1,0,1,0,0|2,0,0]=4 6192 B11R2.845 C1(CC2CCN1C2)C(=O)O MCULE-9084013070 [0,1,0,1,0,0|2,0,0]=4 6193 B11R2.845 CC(=O)C1CC2CCC1C2 MCULE-7085802450 [0,1,0,1,0,0|2,0,0]=4 6194 B11R2.845 CC(=O)C1CC2CCC1O2 MCULE-7697954858 [0,1,0,1,0,0|2,0,0]=4 6195 B11R2.845 O=C(Cl)C1CC2CCC1C2 MCULE-7584777609 [0,1,0,1,0,0|2,0,0]=4 6196 B11R2.845 O=C(O)C1CC2C=CC1C2 MCULE-2570487264 [0,1,0,1,0,0|1,0,1]=4 6197 B11R2.845 O=C(O)C1CC2C=CC1O2 MCULE-4987010609 [0,1,0,1,0,0|1,0,1]=4 6198 B11R2.845 O=C(O)C1CC2CCC1C2 MCULE-2105378214 [0,1,0,1,0,0|1,0,0]=3 6199 B11R2.845 O=C(O)C1CC2CCC1C2 MCULE-5033425758 [0,1,0,1,0,0|1,0,0]=3 6200 B11R2.845 O=C(O)C1CC2CCC1N2 MCULE-3189710002 [0,1,0,1,0,0|1,0,0]=3 6201 B11R2.845 O=C(O)C1CC2CCC1N2 MCULE-8256813957 [0,1,0,1,0,0|1,0,0]=3 6202 B11R2.845 O=C(O)C1CC2CCC1N2 MCULE-8443317854 [0,1,0,1,0,0|1,0,0]=3 6203 B11R2.845 O=C(O)C1CC2CCC1O2 MCULE-9965391385 [0,1,0,1,0,0|1,0,0]=3 6204 B11R2.845 O=C(O)C1CC2CNC1C2 MCULE-4741023802 [0,1,0,1,0,0|0,0,0]=2 6205 B11R2.845 O=C(O)C1CC2CNC1C2 MCULE-8094602403 [0,1,0,1,0,0|0,0,0]=2 6206 B11R2.845 O=C(O)C1C[C@@H]2C=C[C@H]1C2 MCULE-4081139324 [0,1,0,1,0,0|1,0,1]=4 6207 B11R2.845 O=C(O)C1NC2CCC1C2 MCULE-2419483992 [0,1,0,1,0,0|2,0,0]=4 6208 B11R2.845 O=C(O)C1NC2CCC1C2 MCULE-4216750988 [0,1,0,1,0,0|2,0,0]=4 6209 B11R2.845 O=C(O)C1NC2CCC1C2 MCULE-7576433397 [0,1,0,1,0,0|2,0,0]=4 6210 B11R2.845 O=C(O)[C@@H]1C[C@@H]2C=C[C@H]1C2 MCULE-5648526356 [0,1,0,1,0,0|1,0,1]=4 6211 B11R2.845 O=C(O)[C@@H]1C[C@@H]2C=C[C@H]1C2 MCULE-7954090600 [0,1,0,1,0,0|1,0,1]=4 6212 B11R2.845 O=C(O)[C@@H]1C[C@@H]2CC[C@H]1O2 MCULE-6313349669 [0,1,0,1,0,0|1,0,0]=3 6213 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1O2 MCULE-3955948018 [0,1,0,1,0,0|1,0,0]=3 6214 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1O2 MCULE-8797585481 [0,1,0,1,0,0|1,0,0]=3 6215 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@H]1O2 MCULE-4412449728 [0,1,0,1,0,0|1,0,0]=3 6216 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 MCULE-1749677274 [0,1,0,1,0,0|2,0,0]=4 6217 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 MCULE-6361507980 [0,1,0,1,0,0|2,0,0]=4 6218 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@H]1C2 MCULE-8988709359 [0,1,0,1,0,0|2,0,0]=4 6219 B11R2.845 O=C(O)[C@H]1C[C@@H]2C=C[C@H]1C2 MCULE-8288835160 [0,1,0,1,0,0|1,0,1]=4 6220 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1O2 MCULE-5321903258 [0,1,0,1,0,0|1,0,0]=3 6221 B11R2.845 O=C(O)[C@H]1C[C@H]2C=C[C@@H]1C2 MCULE-1850588088 [0,1,0,1,0,0|1,0,1]=4 6222 B11R2.845 O=C(O)[C@H]1C[C@H]2CCN1C2 MCULE-5021740705 [0,1,0,1,0,0|2,0,0]=4 6223 B11R2.845 O=C(O)[C@H]1C[C@H]2CCN1C2 MCULE-5485847471 [0,1,0,1,0,0|2,0,0]=4 6224 B11R2.845 O=C(O)[C@H]1C[C@H]2CCN1C2 MCULE-9168070395 [0,1,0,1,0,0|2,0,0]=4 6225 B11R2.845 O=C(O)[C@H]1C[C@H]2CCN1C2 MCULE-9522296046 [0,1,0,1,0,0|2,0,0]=4 6226 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 MCULE-4397167204 [0,1,0,1,0,0|1,0,0]=3 6227 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1N2 MCULE-6144728165 [0,1,0,1,0,0|1,0,0]=3 6228 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1N2 MCULE-7927159067 [0,1,0,1,0,0|1,0,0]=3 6229 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@H]1O2 MCULE-4984104670 [0,1,0,1,0,0|1,0,0]=3 6230 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 MCULE-5294641154 [0,1,0,1,0,0|2,0,0]=4 6231 B11R2.845 [C@@H]12C=C[C@@H](C1)C(C2)C(=O)O MCULE-5511441102 [0,1,0,1,0,0|1,0,1]=4 6232 B11R2.845 [C@@H]12C=C[C@@H](C1)[C@@H](C2)C(=O)O MCULE-5677861178 [0,1,0,1,0,0|1,0,1]=4 6233 B11R2.845 [C@@H]12C=C[C@@H](C1)[C@H](C2)C(=O)O MCULE-1857694923 [0,1,0,1,0,0|1,0,1]=4 6234 B11R2.845 [C@@H]12CC[C@@H](C1)C(C2)C(=O)O MCULE-7685177551 [0,1,0,1,0,0|1,0,0]=3 6235 B11R2.845 [C@@H]12CC[C@@H](C1)C(C2)C(=O)O MCULE-9283430685 [0,1,0,1,0,0|1,0,0]=3 6236 B11R2.845 [C@@H]12CC[C@@H](N1)C[C@@H]2C(=O)O MCULE-1580122090 [0,1,0,1,0,0|1,0,0]=3 6237 B11R2.845 [C@@H]12CC[C@@H](N1)C[C@@H]2C(=O)O MCULE-2737672800 [0,1,0,1,0,0|1,0,0]=3 6238 B11R2.845 [C@@H]12CC[C@@H](O1)[C@@H](C2)C(=O)O MCULE-7503285059 [0,1,0,1,0,0|1,0,0]=3 6239 B11R2.845 [C@@H]12CC[C@@H](O1)[C@H](C2)C(=O)O MCULE-4865345596 [0,1,0,1,0,0|1,0,0]=3 6240 B11R2.845 [C@@H]12CC[C@H](C1)[C@H](N2)C(=O)O MCULE-2373068137 [0,1,0,1,0,0|2,0,0]=4 6241 B11R2.845 [C@H]12C=C[C@H](O1)C(C2)C(=O)O MCULE-2726310067 [0,1,0,1,0,0|1,0,1]=4 6242 B11R2.845 [C@H]12CCN(C1)[C@@H](C2)C(=O)O MCULE-2799771881 [0,1,0,1,0,0|2,0,0]=4 6243 B11R2.845 [C@H]12CCN(C1)[C@@H](C2)C(=O)O MCULE-9522170914 [0,1,0,1,0,0|2,0,0]=4 6244 B11R2.845 [C@H]12CC[C@H](C1)C(C2)C(=O)C MCULE-5860436538 [0,1,0,1,0,0|2,0,0]=4 6245 B11R2.845 [C@H]12CC[C@H](C1)C(C2)C(=O)C MCULE-7439214349 [0,1,0,1,0,0|2,0,0]=4 6246 B11R2.845 [C@H]12CC[C@H](C1)N[C@@H]2C(=O)O MCULE-2807014544 [0,1,0,1,0,0|2,0,0]=4 6247 B11R2.845 [C@H]12CC[C@H](C1)N[C@@H]2C(=O)O MCULE-8789224031 [0,1,0,1,0,0|2,0,0]=4 6248 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](C2)C(=O)O MCULE-5848404845 [0,1,0,1,0,0|1,0,0]=3 6249 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](C2)C(=O)[O-] MCULE-3276957469 [0,1,0,1,0,0|1,0,1]=4 6250 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-6558374948 [0,1,0,1,0,0|2,0,0]=4 6251 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-6979068312 [0,1,0,1,0,0|2,0,0]=4 6252 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-7785103775 [0,1,0,1,0,0|2,0,0]=4 6253 B11R2.845 [C@H]12CC[C@H](C1)[C@@H](N2)C(=O)O MCULE-9975397997 [0,1,0,1,0,0|2,0,0]=4 6254 B11R2.47 O=C1CC2CCC1CC2=O MCULE-3954884710 [0,1,0,1,0,0|2,0,0]=4 6255 B11R2.411 N[C@@H]1C[C@H]2C[C@]2(C1)C(=O)O MCULE-2111082325 [0,1,0,1,0,0|1,0,0]=3 6256 B11R2.411 N[C@@H]1C[C@H]2C[C@]2(C1)C(=O)O MCULE-4355305095 [0,1,0,1,0,0|1,0,0]=3 6257 B11R2.530 O=C(O)C1C2C1C(=O)CC2 MCULE-6727222040 [0,1,0,1,0,0|1,0,0]=3 6258 B11R2.1826 NC(=O)C12CCCC(C1)C2 MCULE-5396207551 [0,1,0,1,0,0|2,0,0]=4 6259 B11R2.1826 O=C(O)C12CC(C1)CCN2 MCULE-2027717821 [0,1,0,1,0,0|2,0,0]=4 6260 B11R2.1826 O=C(O)C12CC(C1)CCN2 MCULE-3937212667 [0,1,0,1,0,0|2,0,0]=4 6261 B11R2.1826 O=C(O)C12CCCC(C1)C2 MCULE-1931429837 [0,1,0,1,0,0|1,0,0]=3 6262 B11R2.1826 O=C(O)C12CNCC(C1)C2 MCULE-1943461113 [0,1,0,1,0,0|0,0,0]=2 6263 B11R2.1826 O=C(O)C12CNCC(C1)C2 MCULE-5658280461 [0,1,0,1,0,0|0,0,0]=2 6264 B11R2.679 CC12CCC(CC1)OC2=O MCULE-5263749123 [0,1,0,1,0,0|1,0,0]=3 6265 B11R2.1850 CC1(CC2CC2C1)C(=O)O MCULE-5006077474 [0,1,0,1,0,0|1,0,0]=3 6266 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [1,0,0,0,1,0|1,0,1]=4 6267 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [1,0,0,0,1,0|1,0,1]=4 6268 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [1,0,0,0,1,0|1,0,1]=4 6269 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [1,0,0,0,1,0|1,0,1]=4 6270 B7R1.1 BrCC1CCNC1 MCULE-3841325509 [1,0,0,0,1,0|1,0,1]=4 6271 B7R1.1 BrCC1CCNC1 MCULE-4302321173 [1,0,0,0,1,0|1,0,1]=4 6272 B7R1.1 BrCC1CCNC1 MCULE-7802125485 [1,0,0,0,1,0|1,0,1]=4 6273 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [1,0,0,0,1,0|1,0,1]=4 6274 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [1,0,0,0,1,0|1,0,1]=4 6275 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [1,0,0,0,1,0|1,0,1]=4 6276 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [1,0,0,0,1,0|1,0,1]=4 6277 B7R1.1 C#CC1CCCC1 MCULE-2058689962 [1,0,0,0,1,0|1,0,1]=4 6278 B7R1.1 C#CC1CCCN1 MCULE-2312235714 [1,0,0,0,1,0|1,0,1]=4 6279 B7R1.1 C#CC1CCCN1 MCULE-2368649911 [1,0,0,0,1,0|1,0,1]=4 6280 B7R1.1 C#CC1CCNC1 MCULE-5702093443 [1,0,0,0,1,0|1,0,1]=4 6281 B7R1.1 C#CC1CCNC1 MCULE-8837025112 [1,0,0,0,1,0|1,0,1]=4 6282 B7R1.1 C#C[C@@H]1CCCN1 MCULE-1635908608 [1,0,0,0,1,0|1,0,1]=4 6283 B7R1.1 C#C[C@@H]1CCCN1 MCULE-4766446168 [1,0,0,0,1,0|1,0,1]=4 6284 B7R1.1 C#C[C@@H]1CCCN1 MCULE-7265052825 [1,0,0,0,1,0|1,0,1]=4 6285 B7R1.1 C#C[C@@H]1CCCN1 MCULE-8496158135 [1,0,0,0,1,0|1,0,1]=4 6286 B7R1.1 C#C[C@H]1CCCN1 MCULE-1874586489 [1,0,0,0,1,0|1,0,1]=4 6287 B7R1.1 C#C[C@H]1CCCN1 MCULE-8338634355 [1,0,0,0,1,0|1,0,1]=4 6288 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [1,0,0,0,1,0|1,0,1]=4 6289 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [1,0,0,0,1,0|1,0,1]=4 6290 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [1,0,0,0,1,0|1,0,1]=4 6291 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [1,0,0,0,1,0|1,0,1]=4 6292 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [1,0,0,0,1,0|0,0,1]=3 6293 B7R1.1 C1(CCNC1)CC MCULE-1733412139 [1,0,0,0,1,0|1,0,1]=4 6294 B7R1.1 C1(CCNC1)CC MCULE-9295480110 [1,0,0,0,1,0|1,0,1]=4 6295 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [1,0,0,0,1,0|0,0,1]=3 6296 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [1,0,0,0,1,0|0,0,1]=3 6297 B7R1.1 C1(CCNC1)OC MCULE-4107032989 [1,0,0,0,1,0|2,0,0]=4 6298 B7R1.1 C1(CCNC1)OC MCULE-7879953493 [1,0,0,0,1,0|2,0,0]=4 6299 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [1,0,0,0,1,0|1,0,1]=4 6300 B7R1.1 C=CC1CCCC1 MCULE-6144532155 [1,0,0,0,1,0|1,0,0]=3 6301 B7R1.1 C=CC1CCCN1 MCULE-5736974496 [1,0,0,0,1,0|1,0,0]=3 6302 B7R1.1 C=CC1CCCN1 MCULE-7626074228 [1,0,0,0,1,0|1,0,0]=3 6303 B7R1.1 C=CC1CCNC1 MCULE-7703785367 [1,0,0,0,1,0|1,0,0]=3 6304 B7R1.1 CC=C1CCCC1 MCULE-9763131004 [1,0,0,0,1,0|1,0,1]=4 6305 B7R1.1 CC=C1CCNC1 MCULE-9077980338 [1,0,0,0,1,0|1,0,1]=4 6306 B7R1.1 CC=C1CCNC1 MCULE-9519724391 [1,0,0,0,1,0|1,0,1]=4 6307 B7R1.1 CCC1CCCC1 MCULE-1974854934 [1,0,0,0,1,0|1,0,1]=4 6308 B7R1.1 CCC1CCCN1 MCULE-1775351089 [1,0,0,0,1,0|1,0,1]=4 6309 B7R1.1 CCC1CCCN1 MCULE-2065682250 [1,0,0,0,1,0|1,0,1]=4 6310 B7R1.1 CCC1CCCN1 MCULE-8326168982 [1,0,0,0,1,0|1,0,1]=4 6311 B7R1.1 CCC1CCCN1 MCULE-9831560442 [1,0,0,0,1,0|1,0,1]=4 6312 B7R1.1 CCC1CCNC1 MCULE-1558031098 [1,0,0,0,1,0|1,0,1]=4 6313 B7R1.1 CCC1CCNC1 MCULE-1877930466 [1,0,0,0,1,0|1,0,1]=4 6314 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [1,0,0,0,1,0|1,0,1]=4 6315 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [1,0,0,0,1,0|1,0,1]=4 6316 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [1,0,0,0,1,0|1,0,1]=4 6317 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [1,0,0,0,1,0|1,0,1]=4 6318 B7R1.1 CC[C@@H]1CCNC1 MCULE-1468303255 [1,0,0,0,1,0|1,0,1]=4 6319 B7R1.1 CC[C@@H]1CCNC1 MCULE-2434021547 [1,0,0,0,1,0|1,0,1]=4 6320 B7R1.1 CC[C@@H]1CCNC1 MCULE-4288710106 [1,0,0,0,1,0|1,0,1]=4 6321 B7R1.1 CC[C@@H]1CCNC1 MCULE-5295271815 [1,0,0,0,1,0|1,0,1]=4 6322 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [1,0,0,0,1,0|1,0,1]=4 6323 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [1,0,0,0,1,0|1,0,1]=4 6324 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [1,0,0,0,1,0|1,0,1]=4 6325 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [1,0,0,0,1,0|1,0,1]=4 6326 B7R1.1 CC[C@H]1CCNC1 MCULE-5122116015 [1,0,0,0,1,0|1,0,1]=4 6327 B7R1.1 CC[C@H]1CCNC1 MCULE-5302237772 [1,0,0,0,1,0|1,0,1]=4 6328 B7R1.1 CC[C@H]1CCNC1 MCULE-9447387540 [1,0,0,0,1,0|1,0,1]=4 6329 B7R1.1 CC[C@H]1CCNC1 MCULE-9743799071 [1,0,0,0,1,0|1,0,1]=4 6330 B7R1.1 CNC1CCCC1 MCULE-1391832163 [1,0,0,0,1,0|2,0,0]=4 6331 B7R1.1 CNC1CCCC1 MCULE-8242451793 [1,0,0,0,1,0|2,0,0]=4 6332 B7R1.1 CNC1CCNC1 MCULE-5544853841 [1,0,0,0,1,0|2,0,0]=4 6333 B7R1.1 CNC1CCNC1 MCULE-9402107922 [1,0,0,0,1,0|2,0,0]=4 6334 B7R1.1 CN[C@@H]1CCNC1 MCULE-1090651309 [1,0,0,0,1,0|2,0,0]=4 6335 B7R1.1 CN[C@@H]1CCNC1 MCULE-6088625234 [1,0,0,0,1,0|2,0,0]=4 6336 B7R1.1 CN[C@@H]1CCNC1 MCULE-8530771803 [1,0,0,0,1,0|2,0,0]=4 6337 B7R1.1 CN[C@@H]1CCNC1 MCULE-9769572717 [1,0,0,0,1,0|2,0,0]=4 6338 B7R1.1 CN[C@H]1CCNC1 MCULE-3142856248 [1,0,0,0,1,0|2,0,0]=4 6339 B7R1.1 CN[C@H]1CCNC1 MCULE-7615640017 [1,0,0,0,1,0|2,0,0]=4 6340 B7R1.1 CN[C@H]1CCNC1 MCULE-9192229718 [1,0,0,0,1,0|2,0,0]=4 6341 B7R1.1 COC1CCCC1 MCULE-7539347010 [1,0,0,0,1,0|2,0,0]=4 6342 B7R1.1 COC1CCNC1 MCULE-1194889067 [1,0,0,0,1,0|2,0,0]=4 6343 B7R1.1 COC1CCNC1 MCULE-2551543855 [1,0,0,0,1,0|2,0,0]=4 6344 B7R1.1 CO[C@@H]1CCNC1 MCULE-1457133388 [1,0,0,0,1,0|2,0,0]=4 6345 B7R1.1 CO[C@@H]1CCNC1 MCULE-5592053485 [1,0,0,0,1,0|2,0,0]=4 6346 B7R1.1 CO[C@@H]1CCNC1 MCULE-9586958523 [1,0,0,0,1,0|2,0,0]=4 6347 B7R1.1 CO[C@@H]1CCNC1 MCULE-9627985971 [1,0,0,0,1,0|2,0,0]=4 6348 B7R1.1 CO[C@H]1CCNC1 MCULE-4011037765 [1,0,0,0,1,0|2,0,0]=4 6349 B7R1.1 CO[C@H]1CCNC1 MCULE-6371005292 [1,0,0,0,1,0|2,0,0]=4 6350 B7R1.1 CO[C@H]1CCNC1 MCULE-6820243921 [1,0,0,0,1,0|2,0,0]=4 6351 B7R1.1 CO[C@H]1CCNC1 MCULE-9345557765 [1,0,0,0,1,0|2,0,0]=4 6352 B7R1.1 CSC1CCNC1 MCULE-8160363271 [1,0,0,0,1,0|2,0,0]=4 6353 B7R1.1 CSC1CCNC1 MCULE-8993526132 [1,0,0,0,1,0|2,0,0]=4 6354 B7R1.1 CS[C@@H]1CCNC1 MCULE-5068595479 [1,0,0,0,1,0|2,0,0]=4 6355 B7R1.1 CS[C@@H]1CCNC1 MCULE-7615711516 [1,0,0,0,1,0|2,0,0]=4 6356 B7R1.1 CS[C@@H]1CCNC1 MCULE-8265640185 [1,0,0,0,1,0|2,0,0]=4 6357 B7R1.1 CS[C@@H]1CCNC1 MCULE-9548332479 [1,0,0,0,1,0|2,0,0]=4 6358 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [1,0,0,0,1,0|1,0,1]=4 6359 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [1,0,0,0,1,0|1,0,1]=4 6360 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [1,0,0,0,1,0|1,0,1]=4 6361 B7R1.1 ClCC1CCNC1 MCULE-3647066500 [1,0,0,0,1,0|1,0,1]=4 6362 B7R1.1 ClCC1CCNC1 MCULE-4046034551 [1,0,0,0,1,0|1,0,1]=4 6363 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [1,0,0,0,1,0|1,0,1]=4 6364 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [1,0,0,0,1,0|1,0,1]=4 6365 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [1,0,0,0,1,0|1,0,1]=4 6366 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [1,0,0,0,1,0|1,0,1]=4 6367 B7R1.1 ClC[C@@H]1CCNC1 MCULE-3561633948 [1,0,0,0,1,0|1,0,1]=4 6368 B7R1.1 ClC[C@@H]1CCNC1 MCULE-9146547190 [1,0,0,0,1,0|1,0,1]=4 6369 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [1,0,0,0,1,0|1,0,1]=4 6370 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [1,0,0,0,1,0|1,0,1]=4 6371 B7R1.1 ClC[C@H]1CCNC1 MCULE-1113644310 [1,0,0,0,1,0|1,0,1]=4 6372 B7R1.1 ClC[C@H]1CCNC1 MCULE-4950070763 [1,0,0,0,1,0|1,0,1]=4 6373 B7R1.1 FCC1CCCN1 MCULE-3216030316 [1,0,0,0,1,0|1,0,1]=4 6374 B7R1.1 FCC1CCCN1 MCULE-4540803550 [1,0,0,0,1,0|1,0,1]=4 6375 B7R1.1 FCC1CCNC1 MCULE-1978414491 [1,0,0,0,1,0|1,0,1]=4 6376 B7R1.1 FCC1CCNC1 MCULE-5950087621 [1,0,0,0,1,0|1,0,1]=4 6377 B7R1.1 FCC1CCNC1 MCULE-7750703127 [1,0,0,0,1,0|1,0,1]=4 6378 B7R1.1 FCC1CCNC1 MCULE-8603606998 [1,0,0,0,1,0|1,0,1]=4 6379 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [1,0,0,0,1,0|1,0,1]=4 6380 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [1,0,0,0,1,0|1,0,1]=4 6381 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [1,0,0,0,1,0|1,0,1]=4 6382 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [1,0,0,0,1,0|1,0,1]=4 6383 B7R1.1 FC[C@@H]1CCNC1 MCULE-2159002313 [1,0,0,0,1,0|1,0,1]=4 6384 B7R1.1 FC[C@@H]1CCNC1 MCULE-4712597711 [1,0,0,0,1,0|1,0,1]=4 6385 B7R1.1 FC[C@@H]1CCNC1 MCULE-6166975534 [1,0,0,0,1,0|1,0,1]=4 6386 B7R1.1 FC[C@@H]1CCNC1 MCULE-7608233986 [1,0,0,0,1,0|1,0,1]=4 6387 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [1,0,0,0,1,0|1,0,1]=4 6388 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [1,0,0,0,1,0|1,0,1]=4 6389 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [1,0,0,0,1,0|1,0,1]=4 6390 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [1,0,0,0,1,0|1,0,1]=4 6391 B7R1.1 FC[C@H]1CCNC1 MCULE-2828011524 [1,0,0,0,1,0|1,0,1]=4 6392 B7R1.1 FC[C@H]1CCNC1 MCULE-4192540640 [1,0,0,0,1,0|1,0,1]=4 6393 B7R1.1 FC[C@H]1CCNC1 MCULE-5280605995 [1,0,0,0,1,0|1,0,1]=4 6394 B7R1.1 FC[C@H]1CCNC1 MCULE-8886310417 [1,0,0,0,1,0|1,0,1]=4 6395 B7R1.1 ICC1CCCC1 MCULE-5940886897 [1,0,0,0,1,0|1,0,1]=4 6396 B7R1.1 ICC1CCCN1 MCULE-3467617934 [1,0,0,0,1,0|1,0,1]=4 6397 B7R1.1 ICC1CCCN1 MCULE-7784862806 [1,0,0,0,1,0|1,0,1]=4 6398 B7R1.1 ICC1CCNC1 MCULE-4259439945 [1,0,0,0,1,0|1,0,1]=4 6399 B7R1.1 ICC1CCNC1 MCULE-6061564929 [1,0,0,0,1,0|1,0,1]=4 6400 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [1,0,0,0,1,0|1,0,1]=4 6401 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [1,0,0,0,1,0|1,0,1]=4 6402 B7R1.1 N#CC1CCCC1 MCULE-1484517612 [1,0,0,0,1,0|1,0,1]=4 6403 B7R1.1 N#CC1CCCN1 MCULE-1423410021 [1,0,0,0,1,0|1,0,1]=4 6404 B7R1.1 N#CC1CCCN1 MCULE-2656253866 [1,0,0,0,1,0|1,0,1]=4 6405 B7R1.1 N#CC1CCCN1 MCULE-4406196575 [1,0,0,0,1,0|1,0,1]=4 6406 B7R1.1 N#CC1CCCN1 MCULE-7456938108 [1,0,0,0,1,0|1,0,1]=4 6407 B7R1.1 N#CC1CCCN1 MCULE-7786777677 [1,0,0,0,1,0|1,0,1]=4 6408 B7R1.1 N#CC1CCCN1 MCULE-9566371551 [1,0,0,0,1,0|1,0,1]=4 6409 B7R1.1 N#CC1CCNC1 MCULE-2090722666 [1,0,0,0,1,0|1,0,1]=4 6410 B7R1.1 N#CC1CCNC1 MCULE-3197404572 [1,0,0,0,1,0|1,0,1]=4 6411 B7R1.1 N#CC1CCNC1 MCULE-4677394011 [1,0,0,0,1,0|1,0,1]=4 6412 B7R1.1 N#CC1CCNC1 MCULE-7538071104 [1,0,0,0,1,0|1,0,1]=4 6413 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4099952481 [1,0,0,0,1,0|1,0,1]=4 6414 B7R1.1 N#C[C@@H]1CCCN1 MCULE-4644423856 [1,0,0,0,1,0|1,0,1]=4 6415 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5675394665 [1,0,0,0,1,0|1,0,1]=4 6416 B7R1.1 N#C[C@@H]1CCCN1 MCULE-5881469353 [1,0,0,0,1,0|1,0,1]=4 6417 B7R1.1 N#C[C@@H]1CCCN1 MCULE-8875516240 [1,0,0,0,1,0|1,0,1]=4 6418 B7R1.1 N#C[C@@H]1CCCN1 MCULE-9993553976 [1,0,0,0,1,0|1,0,1]=4 6419 B7R1.1 N#C[C@@H]1CCNC1 MCULE-3834395129 [1,0,0,0,1,0|1,0,1]=4 6420 B7R1.1 N#C[C@@H]1CCNC1 MCULE-5148825522 [1,0,0,0,1,0|1,0,1]=4 6421 B7R1.1 N#C[C@@H]1CCNC1 MCULE-6307308537 [1,0,0,0,1,0|1,0,1]=4 6422 B7R1.1 N#C[C@@H]1CCNC1 MCULE-6821015295 [1,0,0,0,1,0|1,0,1]=4 6423 B7R1.1 N#C[C@H]1CCCN1 MCULE-4472756314 [1,0,0,0,1,0|1,0,1]=4 6424 B7R1.1 N#C[C@H]1CCCN1 MCULE-6157392186 [1,0,0,0,1,0|1,0,1]=4 6425 B7R1.1 N#C[C@H]1CCCN1 MCULE-6672062231 [1,0,0,0,1,0|1,0,1]=4 6426 B7R1.1 N#C[C@H]1CCCN1 MCULE-7774660242 [1,0,0,0,1,0|1,0,1]=4 6427 B7R1.1 N#C[C@H]1CCCN1 MCULE-7910694136 [1,0,0,0,1,0|1,0,1]=4 6428 B7R1.1 N#C[C@H]1CCCN1 MCULE-8564583246 [1,0,0,0,1,0|1,0,1]=4 6429 B7R1.1 N#C[C@H]1CCNC1 MCULE-2994856177 [1,0,0,0,1,0|1,0,1]=4 6430 B7R1.1 N#C[C@H]1CCNC1 MCULE-4920099746 [1,0,0,0,1,0|1,0,1]=4 6431 B7R1.1 N#C[C@H]1CCNC1 MCULE-6338524969 [1,0,0,0,1,0|1,0,1]=4 6432 B7R1.1 N#C[C@H]1CCNC1 MCULE-8239077200 [1,0,0,0,1,0|1,0,1]=4 6433 B7R1.1 NCC1CCCC1 MCULE-3629796849 [1,0,0,0,1,0|1,0,1]=4 6434 B7R1.1 NCC1CCCC1 MCULE-8453900433 [1,0,0,0,1,0|1,0,1]=4 6435 B7R1.1 NCC1CCCN1 MCULE-4764684364 [1,0,0,0,1,0|1,0,1]=4 6436 B7R1.1 NCC1CCCN1 MCULE-8971980286 [1,0,0,0,1,0|1,0,1]=4 6437 B7R1.1 NCC1CCNC1 MCULE-1458513231 [1,0,0,0,1,0|1,0,1]=4 6438 B7R1.1 NCC1CCNC1 MCULE-3817893631 [1,0,0,0,1,0|1,0,1]=4 6439 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [1,0,0,0,1,0|1,0,1]=4 6440 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [1,0,0,0,1,0|1,0,1]=4 6441 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [1,0,0,0,1,0|1,0,1]=4 6442 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [1,0,0,0,1,0|1,0,1]=4 6443 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [1,0,0,0,1,0|1,0,1]=4 6444 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [1,0,0,0,1,0|1,0,1]=4 6445 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [1,0,0,0,1,0|1,0,1]=4 6446 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [1,0,0,0,1,0|1,0,1]=4 6447 B7R1.1 NNC1CCCC1 MCULE-1363058529 [1,0,0,0,1,0|2,0,0]=4 6448 B7R1.1 NNC1CCCC1 MCULE-2803402819 [1,0,0,0,1,0|2,0,0]=4 6449 B7R1.1 NNC1CCCC1 MCULE-5556380186 [1,0,0,0,1,0|2,0,0]=4 6450 B7R1.1 NNC1CCNC1 MCULE-2142578337 [1,0,0,0,1,0|2,0,0]=4 6451 B7R1.1 NNC1CCNC1 MCULE-9229134321 [1,0,0,0,1,0|2,0,0]=4 6452 B7R1.1 NOC1CCCC1 MCULE-1504814106 [1,0,0,0,1,0|2,0,0]=4 6453 B7R1.1 NOC1CCCC1 MCULE-1973418119 [1,0,0,0,1,0|2,0,0]=4 6454 B7R1.1 O/N=C/1\CCCN1 MCULE-9494233692 [1,0,0,0,1,0|1,0,1]=4 6455 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [1,0,0,0,1,0|0,0,2]=4 6456 B7R1.1 O=CC1CC=CC1 MCULE-1563456893 [1,0,0,0,1,0|0,0,2]=4 6457 B7R1.1 O=CC1CCCC1 MCULE-4938681495 [1,0,0,0,1,0|0,0,0]=2 6458 B7R1.1 O=CC1CCCO1 MCULE-4587605451 [1,0,0,0,1,0|1,0,0]=3 6459 B7R1.1 O=CC1CCNC1 MCULE-5188223111 [1,0,0,0,1,0|0,0,0]=2 6460 B7R1.1 O=CC1CCOC1 MCULE-9515567606 [1,0,0,0,1,0|1,0,0]=3 6461 B7R1.1 O=CC1CCSC1 MCULE-1282848613 [1,0,0,0,1,0|1,0,0]=3 6462 B7R1.1 O=CN1CCCC1 MCULE-1922854302 [1,0,0,0,1,0|1,0,0]=3 6463 B7R1.1 O=C[C@@H]1CCOC1 MCULE-5181257964 [1,0,0,0,1,0|1,0,0]=3 6464 B7R1.1 O=C[C@H]1CCOC1 MCULE-4532427366 [1,0,0,0,1,0|1,0,0]=3 6465 B7R1.1 O=NN1CCCC1 MCULE-8449068120 [1,0,0,0,1,0|2,0,0]=4 6466 B7R1.1 OCC1CCCC1 MCULE-2985338933 [1,0,0,0,1,0|0,0,1]=3 6467 B7R1.1 OCC1CCCN1 MCULE-1016922679 [1,0,0,0,1,0|0,0,1]=3 6468 B7R1.1 OCC1CCCN1 MCULE-8224535891 [1,0,0,0,1,0|0,0,1]=3 6469 B7R1.1 OCC1CCCO1 MCULE-5877114547 [1,0,0,0,1,0|1,0,1]=4 6470 B7R1.1 OCC1CCCO1 MCULE-5884880244 [1,0,0,0,1,0|1,0,1]=4 6471 B7R1.1 OCC1CCCS1 MCULE-6106081414 [1,0,0,0,1,0|1,0,1]=4 6472 B7R1.1 OCC1CCNC1 MCULE-7883947611 [1,0,0,0,1,0|0,0,1]=3 6473 B7R1.1 OCC1CCNC1 MCULE-9689521155 [1,0,0,0,1,0|0,0,1]=3 6474 B7R1.1 OCC1CCOC1 MCULE-8926405046 [1,0,0,0,1,0|1,0,1]=4 6475 B7R1.1 OCC1CCON1 MCULE-1199975481 [1,0,0,0,1,0|1,0,1]=4 6476 B7R1.1 OCC1CCON1 MCULE-4772487016 [1,0,0,0,1,0|1,0,1]=4 6477 B7R1.1 OCC1CCSC1 MCULE-2226132734 [1,0,0,0,1,0|1,0,1]=4 6478 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [1,0,0,0,1,0|0,0,1]=3 6479 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [1,0,0,0,1,0|0,0,1]=3 6480 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [1,0,0,0,1,0|0,0,1]=3 6481 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [1,0,0,0,1,0|0,0,1]=3 6482 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [1,0,0,0,1,0|1,0,1]=4 6483 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [1,0,0,0,1,0|1,0,1]=4 6484 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [1,0,0,0,1,0|0,0,1]=3 6485 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [1,0,0,0,1,0|0,0,1]=3 6486 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [1,0,0,0,1,0|0,0,1]=3 6487 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [1,0,0,0,1,0|0,0,1]=3 6488 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [1,0,0,0,1,0|1,0,1]=4 6489 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [1,0,0,0,1,0|1,0,1]=4 6490 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [1,0,0,0,1,0|0,0,1]=3 6491 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [1,0,0,0,1,0|0,0,1]=3 6492 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [1,0,0,0,1,0|0,0,1]=3 6493 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [1,0,0,0,1,0|0,0,1]=3 6494 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [1,0,0,0,1,0|1,0,1]=4 6495 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [1,0,0,0,1,0|1,0,1]=4 6496 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [1,0,0,0,1,0|0,0,1]=3 6497 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [1,0,0,0,1,0|0,0,1]=3 6498 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [1,0,0,0,1,0|0,0,1]=3 6499 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [1,0,0,0,1,0|0,0,1]=3 6500 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [1,0,0,0,1,0|1,0,1]=4 6501 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [1,0,0,0,1,0|1,0,1]=4 6502 B7R1.1 ON=C1CCCC1 MCULE-9338449832 [1,0,0,0,1,0|1,0,1]=4 6503 B7R1.1 ONC1CCCC1 MCULE-1143510043 [1,0,0,0,1,0|1,0,0]=3 6504 B7R1.1 ONC1CCCC1 MCULE-7548854169 [1,0,0,0,1,0|1,0,0]=3 6505 B7R1.1 SCC1CCCC1 MCULE-7973872166 [1,0,0,0,1,0|0,1,1]=4 6506 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [0,0,0,0,2,0|0,0,0]=2 6507 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [0,0,0,0,2,0|1,0,0]=3 6508 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [0,0,0,0,2,0|1,0,0]=3 6509 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [0,0,0,0,2,0|1,0,0]=3 6510 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [0,0,0,0,2,0|1,0,0]=3 6511 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [0,0,0,0,2,0|2,0,0]=4 6512 B7R1.18 CC(=O)N1CCC1 MCULE-6467100562 [0,0,0,0,2,0|2,0,0]=4 6513 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [0,0,0,0,2,0|1,0,1]=4 6514 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [0,0,0,0,2,0|1,0,1]=4 6515 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [0,0,0,0,2,0|1,0,1]=4 6516 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [0,0,0,0,2,0|1,0,1]=4 6517 B7R1.18 CS(=O)C1CNC1 MCULE-1896314246 [0,0,0,0,2,0|2,0,0]=4 6518 B7R1.18 CS(=O)C1CNC1 MCULE-3655021594 [0,0,0,0,2,0|2,0,0]=4 6519 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [0,0,0,0,2,0|1,0,1]=4 6520 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [0,0,0,0,2,0|1,0,1]=4 6521 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [0,0,0,0,2,0|1,0,1]=4 6522 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [0,0,0,0,2,0|1,0,1]=4 6523 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [0,0,0,0,2,0|1,0,1]=4 6524 B7R1.18 N=C(N)C1CCC1 MCULE-3470535674 [0,0,0,0,2,0|2,0,0]=4 6525 B7R1.18 N=C(N)C1CCC1 MCULE-4802517706 [0,0,0,0,2,0|2,0,0]=4 6526 B7R1.18 N=C(N)C1CCC1 MCULE-5858986439 [0,0,0,0,2,0|2,0,0]=4 6527 B7R1.18 NC(=O)C1CCC1 MCULE-5151176129 [0,0,0,0,2,0|1,0,0]=3 6528 B7R1.18 NC(=O)C1CCN1 MCULE-1856696035 [0,0,0,0,2,0|1,0,0]=3 6529 B7R1.18 NC(=O)C1CCN1 MCULE-5757704016 [0,0,0,0,2,0|1,0,0]=3 6530 B7R1.18 NC(=O)C1CNC1 MCULE-2319282799 [0,0,0,0,2,0|1,0,0]=3 6531 B7R1.18 NC(=O)C1CNC1 MCULE-4985073048 [0,0,0,0,2,0|1,0,0]=3 6532 B7R1.18 NC(=O)C1CNC1 MCULE-8796959516 [0,0,0,0,2,0|1,0,0]=3 6533 B7R1.18 NC(=O)C1COC1 MCULE-1077689713 [0,0,0,0,2,0|2,0,0]=4 6534 B7R1.18 NC(=O)N1CCC1 MCULE-1594728830 [0,0,0,0,2,0|2,0,0]=4 6535 B7R1.18 NC(=O)[C@H]1CCN1 MCULE-7187425143 [0,0,0,0,2,0|1,0,0]=3 6536 B7R1.18 NC(=S)C1CCC1 MCULE-9753547991 [0,0,0,0,2,0|1,1,0]=4 6537 B7R1.18 O=C(Cl)C1CCC1 MCULE-2155859428 [0,0,0,0,2,0|1,0,0]=3 6538 B7R1.18 O=C(Cl)N1CCC1 MCULE-8313088104 [0,0,0,0,2,0|2,0,0]=4 6539 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [0,0,0,0,2,0|0,0,2]=4 6540 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [0,0,0,0,2,0|0,0,0]=2 6541 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [0,0,0,0,2,0|0,0,0]=2 6542 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [0,0,0,0,2,0|0,0,0]=2 6543 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [0,0,0,0,2,0|0,0,0]=2 6544 B7R1.18 O=C(O)C1CCO1 MCULE-6065911736 [0,0,0,0,2,0|1,0,0]=3 6545 B7R1.18 O=C(O)C1CCO1 MCULE-9296370119 [0,0,0,0,2,0|1,0,0]=3 6546 B7R1.18 O=C(O)C1CNC1 MCULE-2350328355 [0,0,0,0,2,0|0,0,0]=2 6547 B7R1.18 O=C(O)C1CNC1 MCULE-7890374869 [0,0,0,0,2,0|0,0,0]=2 6548 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [0,0,0,0,2,0|1,0,0]=3 6549 B7R1.18 O=C(O)C1CSC1 MCULE-4019152056 [0,0,0,0,2,0|1,0,0]=3 6550 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [0,0,0,0,2,0|0,0,0]=2 6551 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [0,0,0,0,2,0|0,0,0]=2 6552 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [0,0,0,0,2,0|0,0,0]=2 6553 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [0,0,0,0,2,0|0,0,0]=2 6554 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-5117442811 [0,0,0,0,2,0|1,0,0]=3 6555 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-8116248615 [0,0,0,0,2,0|1,0,0]=3 6556 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [0,0,0,0,2,0|0,0,0]=2 6557 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [0,0,0,0,2,0|0,0,0]=2 6558 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [0,0,0,0,2,0|0,0,0]=2 6559 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [0,0,0,0,2,0|0,0,0]=2 6560 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-5499247834 [0,0,0,0,2,0|1,0,0]=3 6561 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-7468207073 [0,0,0,0,2,0|1,0,0]=3 6562 B7R1.18 O=N(=O)C1CCC1 MCULE-1263563910 [0,0,0,0,2,0|1,0,1]=4 6563 B7R1.18 O=S([O-])C1CCC1 MCULE-2181260614 [0,0,0,0,2,0|1,0,1]=4 6564 B7R1.18 O=S([O-])C1CCC1 MCULE-5691798035 [0,0,0,0,2,0|1,0,1]=4 6565 B7R1.18 OB(O)C1CCC1 MCULE-3574521261 [0,0,0,0,2,0|1,0,1]=4 6566 B9R0.14 C=CC(CCC)CC(=O)O MCULE-7907267151 [0,0,1,0,0,1|1,0,1]=4 6567 B9R0.14 CCCC(CC)CC(=O)O MCULE-7716353443 [0,0,1,0,0,1|1,0,0]=3 6568 B9R0.14 CCCC(CC)OC(=O)C MCULE-8250494331 [0,0,1,0,0,1|2,0,0]=4 6569 B9R0.14 CCCC(CC)OC(=O)Cl MCULE-1870486997 [0,0,1,0,0,1|2,0,0]=4 6570 B9R1.89 C#CC1CCCCNC1 MCULE-1408244571 [1,0,0,0,0,1|1,0,1]=4 6571 B9R1.89 C#CC1CCCCNC1 MCULE-8428822099 [1,0,0,0,0,1|1,0,1]=4 6572 B9R1.89 CCC1CCCNCC1 MCULE-1208066309 [1,0,0,0,0,1|1,0,1]=4 6573 B9R1.89 CCC1CNCCCO1 MCULE-5736441757 [1,0,0,0,0,1|1,0,1]=4 6574 B9R1.89 CCC1CNCCOC1 MCULE-8196044665 [1,0,0,0,0,1|1,0,1]=4 6575 B9R1.89 CNC1CCCCNC1 MCULE-4863452887 [1,0,0,0,0,1|2,0,0]=4 6576 B9R1.89 CNC1CCCNCC1 MCULE-5093645225 [1,0,0,0,0,1|2,0,0]=4 6577 B9R1.89 COC1CCCNCC1 MCULE-3865112637 [1,0,0,0,0,1|2,0,0]=4 6578 B9R1.89 COC1CCCNCC1 MCULE-8695975811 [1,0,0,0,0,1|2,0,0]=4 6579 B9R1.89 COC1CNCCNC1 MCULE-1833812784 [1,0,0,0,0,1|2,0,0]=4 6580 B9R1.89 COC1CNCCNC1 MCULE-7875554019 [1,0,0,0,0,1|2,0,0]=4 6581 B9R1.89 CO[C@@H]1CCCNCC1 MCULE-7843793451 [1,0,0,0,0,1|2,0,0]=4 6582 B9R1.89 CO[C@@H]1CCCNCC1 MCULE-8658047616 [1,0,0,0,0,1|2,0,0]=4 6583 B9R1.89 CO[C@H]1CCCNCC1 MCULE-3812820732 [1,0,0,0,0,1|2,0,0]=4 6584 B9R1.89 CO[C@H]1CCCNCC1 MCULE-5564803880 [1,0,0,0,0,1|2,0,0]=4 6585 B9R1.89 CO[C@H]1CCCNCC1 MCULE-7219983991 [1,0,0,0,0,1|2,0,0]=4 6586 B9R1.89 CO[C@H]1CCCNCC1 MCULE-9051418657 [1,0,0,0,0,1|2,0,0]=4 6587 B9R1.89 CSC1CCCNCC1 MCULE-9991697550 [1,0,0,0,0,1|2,0,0]=4 6588 B9R1.89 FCC1CNCCCO1 MCULE-4304507356 [1,0,0,0,0,1|1,0,1]=4 6589 B9R1.89 FCC1CNCCCO1 MCULE-5204425397 [1,0,0,0,0,1|1,0,1]=4 6590 B9R1.89 N#CC1CCCCNC1 MCULE-5438753302 [1,0,0,0,0,1|1,0,1]=4 6591 B9R1.89 N#CC1CCCCNC1 MCULE-9604206710 [1,0,0,0,0,1|1,0,1]=4 6592 B9R1.89 N#CC1CCCNCC1 MCULE-7823129952 [1,0,0,0,0,1|1,0,1]=4 6593 B9R1.89 N#CC1CCCNCC1 MCULE-9329860958 [1,0,0,0,0,1|1,0,1]=4 6594 B9R1.89 N#C[C@H]1CCCNCC1 MCULE-5883510244 [1,0,0,0,0,1|1,0,1]=4 6595 B9R1.89 N#C[C@H]1CCCNCC1 MCULE-5923469533 [1,0,0,0,0,1|1,0,1]=4 6596 B9R1.89 NCC1CCCCNC1 MCULE-7705035602 [1,0,0,0,0,1|1,0,1]=4 6597 B9R1.89 NCC1CCCCNC1 MCULE-8170909949 [1,0,0,0,0,1|1,0,1]=4 6598 B9R1.89 O/N=C/1\CCCNCC1 MCULE-1287556104 [1,0,0,0,0,1|1,0,1]=4 6599 B9R1.89 O=CC1=CCCCCC1 MCULE-8414068028 [1,0,0,0,0,1|1,0,1]=4 6600 B9R1.89 O=CC1CCCCCC1 MCULE-2750232256 [1,0,0,0,0,1|1,0,0]=3 6601 B9R1.89 O=CC1CCCOCC1 MCULE-9140244119 [1,0,0,0,0,1|1,0,0]=3 6602 B9R1.89 O=CC1COCCOC1 MCULE-8006105385 [1,0,0,0,0,1|1,0,0]=3 6603 B9R1.89 O=CN1CCCCCC1 MCULE-9803587111 [1,0,0,0,0,1|2,0,0]=4 6604 B9R1.89 O=CN1CCCNCC1 MCULE-3436524888 [1,0,0,0,0,1|1,0,0]=3 6605 B9R1.89 OCC1CCCCCC1 MCULE-1749370417 [1,0,0,0,0,1|1,0,1]=4 6606 B9R1.89 OCC1CCCCCC1 MCULE-2629813419 [1,0,0,0,0,1|1,0,1]=4 6607 B9R1.89 OCC1CCCCCN1 MCULE-1586506984 [1,0,0,0,0,1|1,0,1]=4 6608 B9R1.89 OCC1CCCCNC1 MCULE-1649629703 [1,0,0,0,0,1|0,0,1]=3 6609 B9R1.89 OCC1CCCCNC1 MCULE-6297064506 [1,0,0,0,0,1|0,0,1]=3 6610 B9R1.89 OCC1CCCNCC1 MCULE-1276268438 [1,0,0,0,0,1|0,0,1]=3 6611 B9R1.89 OCC1CCCNCC1 MCULE-6937244427 [1,0,0,0,0,1|0,0,1]=3 6612 B9R1.89 OCC1CCNCCO1 MCULE-9176508562 [1,0,0,0,0,1|1,0,1]=4 6613 B9R1.89 OCC1CNCCCO1 MCULE-7903525804 [1,0,0,0,0,1|0,0,1]=3 6614 B9R1.89 OCC1CNCCCO1 MCULE-9908272497 [1,0,0,0,0,1|0,0,1]=3 6615 B9R1.89 OCC1CNCCOC1 MCULE-9049672869 [1,0,0,0,0,1|0,0,1]=3 6616 B9R1.89 OCC1COCCOC1 MCULE-3330785002 [1,0,0,0,0,1|1,0,1]=4 6617 B9R1.89 OC[C@@H]1CCCCCN1 MCULE-3068262302 [1,0,0,0,0,1|1,0,1]=4 6618 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-3544932007 [1,0,0,0,0,1|0,0,1]=3 6619 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-4726628241 [1,0,0,0,0,1|0,0,1]=3 6620 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5225680882 [1,0,0,0,0,1|0,0,1]=3 6621 B9R1.89 OC[C@@H]1CNCCCO1 MCULE-5475510815 [1,0,0,0,0,1|0,0,1]=3 6622 B9R1.89 OC[C@H]1CNCCCO1 MCULE-2922219127 [1,0,0,0,0,1|0,0,1]=3 6623 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3177968218 [1,0,0,0,0,1|0,0,1]=3 6624 B9R1.89 OC[C@H]1CNCCCO1 MCULE-3793527665 [1,0,0,0,0,1|0,0,1]=3 6625 B9R1.89 OC[C@H]1CNCCCO1 MCULE-7260252629 [1,0,0,0,0,1|0,0,1]=3 6626 B11R1.91 CC(=O)CCC1CCCCC1 MCULE-1125647515 [0,0,0,0,0,2|2,0,0]=4 6627 B11R1.91 CC(=O)NCC1CCCNC1 MCULE-2486103137 [0,0,0,0,0,2|1,0,0]=3 6628 B11R1.91 CC(=O)NCC1CNCCO1 MCULE-5014922423 [0,0,0,0,0,2|2,0,0]=4 6629 B11R1.91 CC(=O)OCC1CCCCC1 MCULE-4442955915 [0,0,0,0,0,2|2,0,0]=4 6630 B11R1.91 CC(=O)OCC1CCCNC1 MCULE-3753425352 [0,0,0,0,0,2|1,0,0]=3 6631 B11R1.91 CC(=O)OCC1CCCNC1 MCULE-8547366652 [0,0,0,0,0,2|1,0,0]=3 6632 B11R1.91 NC(=O)CCC1CCCCC1 MCULE-7177254920 [0,0,0,0,0,2|2,0,0]=4 6633 B11R1.91 NC(=O)CCC1CCCNC1 MCULE-2731987615 [0,0,0,0,0,2|1,0,0]=3 6634 B11R1.91 NC(=O)CCC1CCCNC1 MCULE-3357409507 [0,0,0,0,0,2|1,0,0]=3 6635 B11R1.91 NC(=O)COC1CCCCC1 MCULE-3634561714 [0,0,0,0,0,2|2,0,0]=4 6636 B11R1.91 NC(=O)CSC1CCCCC1 MCULE-9968891969 [0,0,0,0,0,2|2,0,0]=4 6637 B11R1.91 NC(=O)NCC1CCCCC1 MCULE-8898827465 [0,0,0,0,0,2|2,0,0]=4 6638 B11R1.91 NC(=O)NCC1CCCNC1 MCULE-6134280325 [0,0,0,0,0,2|1,0,0]=3 6639 B11R1.91 O=C(Cl)CCC1CCCCC1 MCULE-7905035887 [0,0,0,0,0,2|2,0,0]=4 6640 B11R1.91 O=C(Cl)OCC1CCCCC1 MCULE-5198631423 [0,0,0,0,0,2|2,0,0]=4 6641 B11R1.91 O=C(O)/C=C/C1CCCCC1 MCULE-3408838682 [0,0,0,0,0,2|1,0,0]=3 6642 B11R1.91 O=C(O)/C=N/N1CCCCC1 MCULE-4664019093 [0,0,0,0,0,2|2,0,0]=4 6643 B11R1.91 O=C(O)/C=N/N1CCCCC1 MCULE-7026085314 [0,0,0,0,0,2|2,0,0]=4 6644 B11R1.91 O=C(O)C#CC1CCCCC1 MCULE-5082053122 [0,0,0,0,0,2|1,0,0]=3 6645 B11R1.91 O=C(O)C#CC1CCCNC1 MCULE-1364265807 [0,0,0,0,0,2|0,0,0]=2 6646 B11R1.91 O=C(O)C#CC1CCCNC1 MCULE-8856789307 [0,0,0,0,0,2|0,0,0]=2 6647 B11R1.91 O=C(O)C#CC1CCCOC1 MCULE-2694768491 [0,0,0,0,0,2|1,0,0]=3 6648 B11R1.91 O=C(O)C#CC1CCNCC1 MCULE-8935690041 [0,0,0,0,0,2|2,0,0]=4 6649 B11R1.91 O=C(O)C#CC1CCNCC1 MCULE-9868136962 [0,0,0,0,0,2|2,0,0]=4 6650 B11R1.91 O=C(O)C#CC1CCOCC1 MCULE-8516095327 [0,0,0,0,0,2|2,0,0]=4 6651 B11R1.91 O=C(O)C=CC1CC=CCC1 MCULE-4029530091 [0,0,0,0,0,2|1,0,1]=4 6652 B11R1.91 O=C(O)C=CC1CCCCC1 MCULE-4284204201 [0,0,0,0,0,2|1,0,0]=3 6653 B11R1.91 O=C(O)C=CC1CCOCC1 MCULE-1964035700 [0,0,0,0,0,2|2,0,0]=4 6654 B11R1.91 O=C(O)CCC1CCCCC1 MCULE-6857024600 [0,0,0,0,0,2|1,0,0]=3 6655 B11R1.91 O=C(O)CCC1CCCCN1 MCULE-9745963762 [0,0,0,0,0,2|2,0,0]=4 6656 B11R1.91 O=C(O)CCC1CCCCN1 MCULE-9799515880 [0,0,0,0,0,2|2,0,0]=4 6657 B11R1.91 O=C(O)CCC1CCCCO1 MCULE-7131400209 [0,0,0,0,0,2|2,0,0]=4 6658 B11R1.91 O=C(O)CCC1CCCNC1 MCULE-7924528861 [0,0,0,0,0,2|0,0,0]=2 6659 B11R1.91 O=C(O)CCC1CCCNC1 MCULE-8138582183 [0,0,0,0,0,2|0,0,0]=2 6660 B11R1.91 O=C(O)CCC1CCCOC1 MCULE-2925847386 [0,0,0,0,0,2|1,0,0]=3 6661 B11R1.91 O=C(O)CCC1CCNCC1 MCULE-2827451677 [0,0,0,0,0,2|2,0,0]=4 6662 B11R1.91 O=C(O)CCC1CCNCC1 MCULE-4045148324 [0,0,0,0,0,2|2,0,0]=4 6663 B11R1.91 O=C(O)CCC1CCOCC1 MCULE-6529848078 [0,0,0,0,0,2|2,0,0]=4 6664 B11R1.91 O=C(O)CCC1CNCCN1 MCULE-1513049995 [0,0,0,0,0,2|1,0,0]=3 6665 B11R1.91 O=C(O)CCC1CNCCN1 MCULE-4856628745 [0,0,0,0,0,2|1,0,0]=3 6666 B11R1.91 O=C(O)CCC1CNCCN1 MCULE-8947965996 [0,0,0,0,0,2|1,0,0]=3 6667 B11R1.91 O=C(O)CCC1CNCCO1 MCULE-4290804660 [0,0,0,0,0,2|1,0,0]=3 6668 B11R1.91 O=C(O)CCC1CNCCO1 MCULE-8003417383 [0,0,0,0,0,2|1,0,0]=3 6669 B11R1.91 O=C(O)CCC1COCCN1 MCULE-2173241934 [0,0,0,0,0,2|2,0,0]=4 6670 B11R1.91 O=C(O)CCC1COCCN1 MCULE-4800776369 [0,0,0,0,0,2|2,0,0]=4 6671 B11R1.91 O=C(O)CCC1COCCO1 MCULE-8260042590 [0,0,0,0,0,2|2,0,0]=4 6672 B11R1.91 O=C(O)CCN1CCCCC1 MCULE-4134014685 [0,0,0,0,0,2|2,0,0]=4 6673 B11R1.91 O=C(O)CCN1CCCCC1 MCULE-8800912377 [0,0,0,0,0,2|2,0,0]=4 6674 B11R1.91 O=C(O)CC[C@@H]1CNCCO1 MCULE-1561801705 [0,0,0,0,0,2|1,0,0]=3 6675 B11R1.91 O=C(O)CC[C@@H]1CNCCO1 MCULE-1829190625 [0,0,0,0,0,2|1,0,0]=3 6676 B11R1.91 O=C(O)CC[C@H]1CNCCO1 MCULE-4904929048 [0,0,0,0,0,2|1,0,0]=3 6677 B11R1.91 O=C(O)CC[C@H]1CNCCO1 MCULE-9655711335 [0,0,0,0,0,2|1,0,0]=3 6678 B11R1.91 O=C(O)CNC1CCCCC1 MCULE-5220210342 [0,0,0,0,0,2|1,0,0]=3 6679 B11R1.91 O=C(O)CNC1CCCCC1 MCULE-9313520636 [0,0,0,0,0,2|1,0,0]=3 6680 B11R1.91 O=C(O)CNC1CCOCC1 MCULE-7657301692 [0,0,0,0,0,2|2,0,0]=4 6681 B11R1.91 O=C(O)COC1CCCCC1 MCULE-9015047559 [0,0,0,0,0,2|1,0,0]=3 6682 B11R1.91 O=C(O)COC1CCCOC1 MCULE-6982251312 [0,0,0,0,0,2|1,0,0]=3 6683 B11R1.91 O=C(O)COC1CCNCC1 MCULE-8120083070 [0,0,0,0,0,2|2,0,0]=4 6684 B11R1.91 O=C(O)COC1CCNCC1 MCULE-9462178764 [0,0,0,0,0,2|2,0,0]=4 6685 B11R1.91 O=C(O)COC1CCOCC1 MCULE-2803382098 [0,0,0,0,0,2|2,0,0]=4 6686 B11R1.91 O=C(O)CSC1CCCCC1 MCULE-2242180425 [0,0,0,0,0,2|1,0,0]=3 6687 B11R1.91 O=C(O)CSC1CCCCO1 MCULE-8580492168 [0,0,0,0,0,2|2,0,0]=4 6688 B11R1.742 CC(=O)CC1CCCCCN1 MCULE-2355996760 [0,0,0,0,0,2|2,0,0]=4 6689 B11R1.742 CC(=O)NC1CCCCCC1 MCULE-3697459369 [0,0,0,0,0,2|2,0,0]=4 6690 B11R1.742 NC(=O)CN1CCCNCC1 MCULE-5276262579 [0,0,0,0,0,2|2,0,0]=4 6691 B11R1.742 NC(=O)CN1CCCNCC1 MCULE-6950928492 [0,0,0,0,0,2|2,0,0]=4 6692 B11R1.742 NC(=O)NC1CCCCCC1 MCULE-7737326688 [0,0,0,0,0,2|2,0,0]=4 6693 B11R1.742 O=C(O)C=C1CCCCCC1 MCULE-5228387881 [0,0,0,0,0,2|1,0,1]=4 6694 B11R1.742 O=C(O)CC1CCC=CCC1 MCULE-8122130448 [0,0,0,0,0,2|1,0,1]=4 6695 B11R1.742 O=C(O)CC1CCCCCC1 MCULE-3247091796 [0,0,0,0,0,2|1,0,0]=3 6696 B11R1.742 O=C(O)CC1CCCNCC1 MCULE-1259156999 [0,0,0,0,0,2|0,0,0]=2 6697 B11R1.742 O=C(O)CC1CCCNCC1 MCULE-8862658650 [0,0,0,0,0,2|0,0,0]=2 6698 B11R1.742 O=C(O)CC1CCCOCC1 MCULE-7663320476 [0,0,0,0,0,2|1,0,0]=3 6699 B11R1.742 O=C(O)CN1CCCCCC1 MCULE-1178025352 [0,0,0,0,0,2|2,0,0]=4 6700 B11R1.742 O=C(O)CN1CCCCCC1 MCULE-1252489424 [0,0,0,0,0,2|2,0,0]=4 6701 B11R1.742 O=C(O)CN1CCCNCC1 MCULE-7410717770 [0,0,0,0,0,2|1,0,0]=3 6702 B11R1.742 O=C(O)CN1CCCNCC1 MCULE-8199207666 [0,0,0,0,0,2|1,0,0]=3 6703 B11R1.742 O=C(O)CN1CSCCSC1 MCULE-4152013932 [0,0,0,0,0,2|2,0,0]=4 6704 B11R1.706 CC(=O)C1CCCCCCC1 MCULE-7453374150 [0,0,0,0,0,2|2,0,0]=4 6705 B11R1.706 O=C(O)C1CCC=CCCC1 MCULE-1202438669 [0,0,0,0,0,2|1,0,0]=3 6706 B11R1.706 O=C(O)C1CCCCCCC1 MCULE-7220278799 [0,0,0,0,0,2|1,0,0]=3 6707 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2852082428 [0,0,0,0,0,2|1,0,0]=3 6708 B11R1.706 O=C(O)C1CCCCCCN1 MCULE-2931630393 [0,0,0,0,0,2|1,0,0]=3