0 B8R0.8 C[Se]CCC(N)C(O)=O HY-B1000 [0,0,0,0,0,0|0,1,0]=1 1 B8R0.8 C[Se]CC[C@H](N)C(O)=O HY-B1000A [0,0,0,0,0,0|0,1,0]=1 2 B8R0.8 NCCC[C@H](N)C(O)=O HY-B1352 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.4 COCCCC(O)=O AC100091 [1,0,0,0,0,0|0,1,0]=2 4 B7R0.5 CCC[C@H](N)C(O)=O AC180580 [1,0,0,0,0,0|0,0,0]=1 5 B7R0.5 COC[C@@H](N)C(O)=O AC021210 [1,0,0,0,0,0|0,1,0]=2 6 B7R0.5 COC[C@H](N)C(O)=O AC511991 [1,0,0,0,0,0|0,1,0]=2 7 B7R0.5 NC(CCO)C(O)=O AC511583 [1,0,0,0,0,0|0,1,0]=2 8 B7R0.5 NCCC(N)C(O)=O AC511576 [1,0,0,0,0,0|1,0,0]=2 9 B7R0.5 NCC[C@H](N)C(O)=O HY-101414 [1,0,0,0,0,0|1,0,0]=2 10 B7R0.5 NCC[C@H](O)C(O)=O AC181087 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.5 N[C@@H](CC#C)C(O)=O AC030195 [1,0,0,0,0,0|0,0,2]=3 12 B7R0.5 N[C@@H](CCO)C(O)=O AC180567 [1,0,0,0,0,0|0,1,0]=2 13 B9R0.7 CC(=O)OC[C@H](N)C(O)=O HY-101409 [0,1,0,0,0,0|2,0,0]=3 14 B9R0.7 NC(CCC(N)=O)C(O)=O HY-B1346 [0,1,0,0,0,0|2,0,0]=3 15 B9R0.7 N[C@@H](CCC(N)=O)C(O)=O HY-N0390 [0,1,0,0,0,0|2,0,0]=3 16 B9R0.7 N[C@H](CCC(N)=O)C(O)=O HY-100587 [0,1,0,0,0,0|2,0,0]=3 17 B9R0.7 N[C@H](CCC(O)=O)C(O)=O AC510929 [0,1,0,0,0,0|2,0,0]=3 18 B9R0.7 N[C@H](CCC(O)=O)C(O)=O HY-100805 [0,1,0,0,0,0|2,0,0]=3 19 B9R0.8 CCCCC(Br)C(=O)OC AC021420 [0,1,0,0,0,0|2,0,0]=3 20 B9R0.47 CCCCC[C@H](N)C(O)=O AC512037 [0,1,0,0,0,0|1,0,0]=2 21 B9R0.47 NCCCC[C@@H](N)C(O)=O AC180292 [0,1,0,0,0,0|1,0,0]=2 22 B9R0.47 NCCOC[C@H](N)C(O)=O HY-U00097 [0,1,0,0,0,0|2,0,0]=3 23 B9R0.47 N[C@@H](CSCC#C)C(O)=O AC160392 [0,1,0,0,0,0|1,0,1]=3 24 B9R1.5 CC1CCNCCC1=O LN00001918 [0,0,0,1,0,0|3,0,0]=4 25 B9R1.5 NC1CCCCNC1=O AC021266 [0,0,0,1,0,0|2,0,0]=3 26 B9R1.5 NC1CCCCNC1=O AC180582 [0,0,0,1,0,0|2,0,0]=3 27 B9R1.5 N[C@@H]1CCCCNC1=O AC180246 [0,0,0,1,0,0|2,0,0]=3 28 B9R1.5 N[C@H]1CCCCNC1=O AC180583 [0,0,0,1,0,0|2,0,0]=3 29 B9R1.6 C1CNC(CN1)C(=O)O LN00009512 [0,0,0,1,0,0|2,0,0]=3 30 B9R1.6 CC(=O)C1CCCCC1 AC510963 [0,0,0,1,0,0|3,0,0]=4 31 B9R1.6 CC(=O)C1CCOCC1 AC220050 [0,0,0,1,0,0|2,1,0]=4 32 B9R1.6 ClC(=O)C1CCOCC1 AC220193 [0,0,0,1,0,0|2,1,0]=4 33 B9R1.6 NC(=O)C1CCNCC1 AC511687 [0,0,0,1,0,0|3,0,0]=4 34 B9R1.6 NC(=O)C1CCOCC1 AC220035 [0,0,0,1,0,0|2,1,0]=4 35 B9R1.6 OC(=O)C1=CCNCC1 HY-100810 [0,0,0,1,0,0|2,0,1]=4 36 B9R1.6 OC(=O)C1CCCCC1 AC190179 [0,0,0,1,0,0|2,0,0]=3 37 B9R1.6 OC(=O)C1CCCCN1 AC130051 [0,0,0,1,0,0|1,0,0]=2 38 B9R1.6 OC(=O)C1CCCCN1 AC510756 [0,0,0,1,0,0|1,0,0]=2 39 B9R1.6 OC(=O)C1CCCCO1 AC170058 [0,0,0,1,0,0|2,0,0]=3 40 B9R1.6 OC(=O)C1CCCOC1 AC170092 [0,0,0,1,0,0|3,0,0]=4 41 B9R1.6 OC(=O)C1CCNCC1 AC180124 [0,0,0,1,0,0|2,0,0]=3 42 B9R1.6 OC(=O)C1CCOCC1 AC180391 [0,0,0,1,0,0|1,1,0]=3 43 B9R1.6 OC(=O)C1CNCCN1 AC180739 [0,0,0,1,0,0|2,0,0]=3 44 B9R1.6 OC(=O)C1COCCN1 AC170096 [0,0,0,1,0,0|2,0,0]=3 45 B9R1.6 OC(=O)[C@@H]1CCC=CC1 AC310100 [0,0,0,1,0,0|2,0,1]=4 46 B9R1.6 OC(=O)[C@@H]1CNCCN1 AC020777 [0,0,0,1,0,0|2,0,0]=3 47 B9R1.6 OC(=O)[C@@H]1COCCN1 AC181656 [0,0,0,1,0,0|2,0,0]=3 48 B9R1.6 OC(=O)[C@H]1CCC=CC1 AC310113 [0,0,0,1,0,0|2,0,1]=4 49 B9R1.6 OC(=O)[C@H]1CCCCN1 AC180578 [0,0,0,1,0,0|1,0,0]=2 50 B9R1.6 OC(=O)[C@H]1CNCCN1 AC181744 [0,0,0,1,0,0|2,0,0]=3 51 B9R1.35 CN1CCC(C1)C(O)=O AC182036 [0,0,0,1,0,0|2,0,0]=3 52 B9R1.35 OC(=O)C1CCC(=O)C1 AC160621 [0,0,0,1,0,0|3,0,0]=4 53 B9R1.35 OC(=O)C1CCC(=O)N1 AC511521 [0,0,0,1,0,0|2,0,0]=3 54 B9R1.35 OC(=O)[C@@H]1CCC(=O)N1 AC190184 [0,0,0,1,0,0|2,0,0]=3 55 B9R1.35 OC(=O)[C@H]1CCC(=O)N1 AC180591 [0,0,0,1,0,0|2,0,0]=3 56 B9R1.110 NC(C1CCC1)C(O)=O AC050494 [0,0,0,1,0,0|1,0,0]=2 57 B9R1.110 N[C@H](C1CCC1)C(O)=O AC050744 [0,0,0,1,0,0|1,0,0]=2 58 B9R1.163 C1CCC(C1)(C(=O)O)O LN00159103 [0,0,0,1,0,0|2,0,0]=3 59 B9R1.163 C1COCC1(C(=O)O)N LN00170684 [0,0,0,1,0,0|0,1,0]=2 60 B9R1.163 CC1(CSSC1)C(N)=O AC020603 [0,0,0,1,0,0|3,0,0]=4 61 B9R1.163 C[C@@]1(CCCN1)C(=O)O LN00231771 [0,0,0,1,0,0|3,0,0]=4 62 B9R1.163 C[C@@]1(CCCN1)C(O)=O AC021002 [0,0,0,1,0,0|3,0,0]=4 63 B9R1.163 C[C@]1(CCCN1)C(O)=O AC020387 [0,0,0,1,0,0|3,0,0]=4 64 B9R1.163 C[C@]1(CCCN1)C(O)=O AC021246 [0,0,0,1,0,0|3,0,0]=4 65 B9R1.163 NC1(CCCC1)C(O)=O AC511825 [0,0,0,1,0,0|1,0,0]=2 66 B9R1.163 NC1(CCNC1)C(O)=O AC021073 [0,0,0,1,0,0|1,0,0]=2 67 B6R0.1 CCC[C@H](N)CO AC020141 [2,0,0,0,0,0|0,0,1]=3 68 B6R0.4 CC(=O)CCCCl AC511746 [2,0,0,0,0,0|2,0,0]=4 69 B6R0.4 CCCCB(O)O AC090160 [2,0,0,0,0,0|1,0,1]=4 70 B6R0.4 CCCOC(N)=O AC512151 [2,0,0,0,0,0|2,0,0]=4 71 B6R0.4 COCCC(O)=O AC100057 [2,0,0,0,0,0|0,1,0]=3 72 B6R0.4 CSCCC(O)=O HY-101401 [2,0,0,0,0,0|0,0,0]=2 73 B6R0.4 OC(=O)CCC#C AC510868 [2,0,0,0,0,0|0,0,2]=4 74 B6R0.4 OC(=O)CCC#N AC512077 [2,0,0,0,0,0|1,0,1]=4 75 B6R0.4 OC(=O)CCC=C AC511045 [2,0,0,0,0,0|0,0,2]=4 76 B6R0.4 OC(=O)CCCBr AC511629 [2,0,0,0,0,0|1,0,0]=3 77 B6R0.6 ClCCCCC=O AC511901 [2,0,0,0,0,0|2,0,0]=4 78 B6R0.6 OCCCCC=O AC511239 [2,0,0,0,0,0|2,0,0]=4 79 B6R0.3 CCC(C)C(O)=O AC180050 [2,0,0,0,0,0|1,0,0]=3 80 B6R0.3 CCC(N)C(N)=O AC021619 [2,0,0,0,0,0|1,0,0]=3 81 B6R0.3 CC[C@@H](N)C(O)=O AC180579 [2,0,0,0,0,0|0,0,0]=2 82 B6R0.3 CC[C@H](N)C(O)=O AC511519 [2,0,0,0,0,0|0,0,0]=2 83 B6R0.3 COC(C)C(O)=O AC511149 [2,0,0,0,0,0|1,1,0]=4 84 B6R0.3 CO[C@@H](C)C(O)=O AC100006 [2,0,0,0,0,0|1,1,0]=4 85 B6R0.3 NC[C@H](N)C(O)=O AC511517 [2,0,0,0,0,0|1,0,0]=3 86 B6R0.3 N[C@H](CO)C(O)=O AC180073 [2,0,0,0,0,0|0,1,0]=3 87 B6R0.3 N[C@H](CS)C(O)=O AC180279 [2,0,0,0,0,0|0,0,0]=2 88 B8R0.7 NCCCCCC(O)=O AC510865 [1,1,0,0,0,0|1,0,0]=3 89 B8R0.7 NCCCCCC(O)=O HY-B0236 [1,1,0,0,0,0|1,0,0]=3 90 B8R0.7 OC(=O)CCCCCBr AC510767 [1,1,0,0,0,0|1,0,0]=3 91 B8R0.28 CC(=O)CCCC(O)=O AC180079 [1,1,0,0,0,0|1,0,0]=3 92 B8R0.28 CN(C)CCCC(O)=O AC130623 [1,1,0,0,0,0|1,0,0]=3 93 B8R0.2 CCC(C)C(N)C(O)=O AC510945 [1,1,0,0,0,0|0,0,0]=2 94 B8R0.2 CC[C@H](C)[C@@H](C(=N)O)N LN00239756 [1,1,0,0,0,0|1,0,0]=3 95 B8R0.23 CC(C)C[C@@H](N)C(O)=O AC180566 [1,1,0,0,0,0|0,0,0]=2 96 B10R0.82 COC(=O)CC[C@H](N)C(O)=O AC511522 [0,2,0,0,0,0|0,1,0]=3 97 B10R0.75 N[C@@H](CSCCCO)C(O)=O HY-B0393 [0,2,0,0,0,0|1,0,0]=3 98 B8R1.2 O=CC1CCOCC1 AC220055 [1,0,0,1,0,0|1,1,0]=4 99 B8R1.2 OC[C@@H]1CCCCN1 AC160434 [1,0,0,1,0,0|1,0,1]=4 100 B8R1.5 N[C@@H]1CCCC[C@H]1O AC182207 [1,0,0,1,0,0|1,0,1]=4 101 B8R1.5 N[C@H]1CCCC[C@@H]1O AC130140 [1,0,0,1,0,0|1,0,1]=4 102 B8R1.5 N[C@H]1CCCNC1=O AC182393 [1,0,0,1,0,0|2,0,0]=4 103 B8R1.4 CN1CCCC(=O)C1 AC182125 [1,0,0,1,0,0|2,0,0]=4 104 B8R1.7 CC(=O)C1CCCC1 AC512080 [1,0,0,1,0,0|2,0,0]=4 105 B8R1.7 CC(=O)C1CCOC1 AC220028 [1,0,0,1,0,0|1,1,0]=4 106 B8R1.7 OC(=O)C1CC=CC1 AC180693 [1,0,0,1,0,0|1,0,1]=4 107 B8R1.7 OC(=O)C1CCCC1 AC180019 [1,0,0,1,0,0|1,0,0]=3 108 B8R1.7 OC(=O)C1CCCC1 AC500306 [1,0,0,1,0,0|1,0,0]=3 109 B8R1.7 OC(=O)C1CCCO1 AC511285 [1,0,0,1,0,0|2,0,0]=4 110 B8R1.7 OC(=O)C1CCCS1 AC040081 [1,0,0,1,0,0|2,0,0]=4 111 B8R1.7 OC(=O)C1CCOC1 AC190250 [1,0,0,1,0,0|0,1,0]=3 112 B8R1.7 OC(=O)C1CSSC1 AC020754 [1,0,0,1,0,0|1,0,0]=3 113 B8R1.7 OC(=O)C1CSSC1 HY-50730 [1,0,0,1,0,0|1,0,0]=3 114 B8R1.7 OC(=O)[C@@H]1CCCO1 AC190278 [1,0,0,1,0,0|2,0,0]=4 115 B8R1.7 OC(=O)[C@@H]1CCNC1 AC182243 [1,0,0,1,0,0|1,0,0]=3 116 B8R1.7 OC(=O)[C@H]1CCNC1 AC182027 [1,0,0,1,0,0|1,0,0]=3 117 B8R1.34 OC(=O)CC1CCC1 AC050613 [1,0,0,1,0,0|1,0,0]=3 118 B8R1.23 CN1CC(C1)C(O)=O AC190103 [1,0,0,1,0,0|2,0,0]=4 119 B8R1.78 CC1(CCC1)C(O)=O AC511926 [1,0,0,1,0,0|1,0,0]=3 120 B8R1.78 CC1(COC1)C(O)=O AC511641 [1,0,0,1,0,0|1,1,0]=4 121 B8R1.78 NC1(CCC1)C(O)=O AC020496 [1,0,0,1,0,0|0,0,0]=2 122 B8R1.78 NC1(CCC1)C(O)=O AC050465 [1,0,0,1,0,0|0,0,0]=2 123 B10R1.18 OC(=O)CC1CCNCC1 AC170072 [0,0,0,1,0,1|2,0,0]=4 124 B10R1.18 OC(=O)CC1CCNCC1 AC181391 [0,0,0,1,0,1|2,0,0]=4 125 B10R1.18 OC(=O)CC1CCOCC1 AC170121 [0,0,0,1,0,1|1,1,0]=4 126 B10R1.23 NC(C1CCNC1)C(O)=O AC050281 [0,1,0,1,0,0|1,0,0]=3 127 B10R1.13 CN1CCC(CC1)C(O)=O AC182011 [0,1,0,1,0,0|2,0,0]=4 128 B10R1.13 CN1CCC(CC1)C(O)=O AC190237 [0,1,0,1,0,0|2,0,0]=4 129 B10R1.13 OC(=O)C1CCC(=O)CC1 AC511132 [0,1,0,1,0,0|2,0,0]=4 130 B10R1.13 OC(=O)C1CCC(=O)CN1 AC160004 [0,1,0,1,0,0|1,0,0]=3 131 B10R1.13 O[C@H]1CC[C@@H](CC1)C(O)=O AC021053 [0,1,0,1,0,0|2,0,0]=4 132 B10R1.14 COC(=O)C1CCC(=O)N1 AC160469 [0,1,0,1,0,0|2,0,0]=4 133 B10R1.14 COC(=O)[C@@H]1CCC(=O)N1 AC180646 [0,1,0,1,0,0|2,0,0]=4 134 B10R1.15 COC(=O)C1CCCCC1 AC511706 [0,1,0,1,0,0|2,0,0]=4 135 B10R1.15 COC(=O)C1CCCCN1 AC182079 [0,1,0,1,0,0|1,0,0]=3 136 B10R1.15 COC(=O)C1CCCCO1 AC170120 [0,1,0,1,0,0|2,0,0]=4 137 B10R1.15 COC(=O)C1CCNCC1 AC181476 [0,1,0,1,0,0|2,0,0]=4 138 B10R1.15 COC(=O)C1CCOCC1 AC181176 [0,1,0,1,0,0|1,1,0]=4 139 B10R1.15 COC(=O)C1COCCN1 AC170108 [0,1,0,1,0,0|2,0,0]=4 140 B10R1.15 COC(=O)[C@@H]1CCCCN1 AC160322 [0,1,0,1,0,0|1,0,0]=3 141 B10R1.15 COC(=O)[C@@H]1COCCN1 AC182525 [0,1,0,1,0,0|2,0,0]=4 142 B10R1.15 COC(=O)[C@H]1CCCCN1 AC160321 [0,1,0,1,0,0|1,0,0]=3 143 B10R1.15 COC(=O)[C@H]1COCCN1 AC200037 [0,1,0,1,0,0|2,0,0]=4 144 B10R1.182 COC(=O)[C@@H](N)C1CCC1 AC050283 [0,1,0,1,0,0|1,0,0]=3 145 B10R1.411 COC(=O)C1(N)CCCC1 AC020280 [0,1,0,1,0,0|1,0,0]=3 146 B10R1.204 NC(CC1CCC1)C(O)=O AC050153 [0,1,0,1,0,0|1,0,0]=3 147 B10R1.204 N[C@@H](CC1CCC1)C(O)=O AC050268 [0,1,0,1,0,0|1,0,0]=3 148 B10R1.204 N[C@@H](CC1CCC1)C(O)=O AC050401 [0,1,0,1,0,0|1,0,0]=3 149 B10R1.363 CC1(CCOCC1)C(O)=O AC182684 [0,1,0,1,0,0|1,1,0]=4 150 B10R1.363 C[C@@]1(CCCCN1)C(O)=O AC020355 [0,1,0,1,0,0|1,0,0]=3 151 B10R1.363 C[C@]1(CCCCN1)C(O)=O AC020354 [0,1,0,1,0,0|1,0,0]=3 152 B10R1.363 NC1(CCNCC1)C(O)=O AC051172 [0,1,0,1,0,0|1,0,0]=3