0 B7R0.6 CC(=O)CCC(=O)O Z104477318 [0,0,0,0,0,0|3,0,0]=3 1 B7R0.6 CC(=O)NCC(=O)O Z85886676 [0,0,0,0,0,0|2,0,1]=3 2 B7R0.6 CC(=O)OCC(=S)N Z411884132 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.6 CC(C)CCC(=O)O Z56347204 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.6 CC(C)NCC(=O)O Z359419672 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.6 CC(C)OCC(=O)O Z316259244 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.6 CC(C)SCC(=O)O Z214812600 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.6 CC(N)CCC(=O)O Z1235963367 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.6 CC(O)CCC(=O)O Z838959470 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.6 CN(C)CCC(=O)O Z168912830 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.6 CS(=O)CCC(=O)O Z667974346 [0,0,0,0,0,0|4,0,0]=4 11 B7R0.6 N=C(N)NCC(=O)O Z586248684 [0,0,0,0,0,0|0,0,2]=2 12 B7R0.6 N=C(N)SCC(=O)O Z2944342055 [0,0,0,0,0,0|1,0,1]=2 13 B7R0.6 NC(=O)C#CC(=O)N Z1203578096 [0,0,0,0,0,0|3,0,1]=4 14 B7R0.6 NC(=O)NCC(=O)O Z57009586 [0,0,0,0,0,0|1,0,1]=2 15 B7R0.6 O=C(O)/C=C/C(=O)O Z57127460 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.6 O=C(O)CCC(=O)O Z57127453 [0,0,0,0,0,0|3,0,0]=3 17 B7R0.6 O=C(O)CN[N+](=O)[O-] Z1198158238 [0,0,0,0,0,0|3,0,1]=4 18 B6R0.4 C#CCCC(=O)O Z295890062 [1,0,0,0,0,0|2,0,1]=4 19 B6R0.4 C=CCCC(=O)C Z406376894 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.4 C=CCCC(=O)O Z995028722 [1,0,0,0,0,0|2,0,0]=3 21 B6R0.4 C=CCNC(=O)N Z56904662 [1,0,0,0,0,0|2,0,1]=4 22 B6R0.4 C=CCNC(=S)N Z56911918 [1,0,0,0,0,0|2,0,1]=4 23 B6R0.4 CCCCC(=O)O Z104473312 [1,0,0,0,0,0|2,0,1]=4 24 B6R0.4 CCNCC(=O)O Z744593094 [1,0,0,0,0,0|1,0,2]=4 25 B6R0.4 CCOCC(=O)O Z104495232 [1,0,0,0,0,0|2,0,1]=4 26 B6R0.4 COCCC(=O)O Z285184634 [1,0,0,0,0,0|3,0,0]=4 27 B6R0.4 CSCCC(=O)O Z54719251 [1,0,0,0,0,0|3,0,0]=4 28 B6R0.4 N=C(N)NCCO Z911465228 [1,0,0,0,0,0|0,0,3]=4 29 B6R0.4 N=C(N)SCCO Z57111959 [1,0,0,0,0,0|1,0,2]=4 30 B6R0.4 NC(=O)CCCO Z1203578394 [1,0,0,0,0,0|2,0,1]=4 31 B6R0.4 NC(=O)OCCO Z1198158440 [1,0,0,0,0,0|2,0,1]=4 32 B6R0.4 NCCCC(=O)N Z398513418 [1,0,0,0,0,0|2,0,1]=4 33 B6R0.4 NCCCC(=O)O Z104475620 [1,0,0,0,0,0|1,0,1]=3 34 B6R0.4 NCCCS(=O)O Z1203579399 [1,0,0,0,0,0|2,0,1]=4 35 B6R0.4 O=C(O)CCCS Z147642510 [1,0,0,0,0,0|2,0,1]=4 36 B8R0.9 C=CC(N)CCC(=O)O Z1255431434 [0,1,0,0,0,0|2,0,1]=4 37 B8R0.9 CC(CN)CCC(=O)O Z1739254655 [0,1,0,0,0,0|2,0,1]=4 38 B8R0.9 CCC(=O)CCC(=O)O Z838955680 [0,1,0,0,0,0|3,0,0]=4 39 B8R0.9 CCC(=O)NCC(=O)O Z85886715 [0,1,0,0,0,0|2,0,1]=4 40 B8R0.9 CNC(=O)CCC(=O)O Z429593572 [0,1,0,0,0,0|2,0,0]=3 41 B8R0.9 CNC(=O)NCC(=O)O Z223126780 [0,1,0,0,0,0|1,0,1]=3 42 B8R0.9 COC(=O)CCC(=O)O Z57663583 [0,1,0,0,0,0|3,0,0]=4 43 B8R0.9 COC(=O)NCC(=O)O Z111492620 [0,1,0,0,0,0|2,0,1]=4 44 B8R0.9 NCC(=O)CCC(=O)O Z1741972992 [0,1,0,0,0,0|2,0,0]=3 45 B8R0.9 NCC(=O)NCC(=O)O Z56896934 [0,1,0,0,0,0|1,0,1]=3 46 B8R0.9 NCC(N)CCC(=O)O Z1259335825 [0,1,0,0,0,0|1,0,1]=3 47 B8R0.23 C=C(C)CC(N)C(=O)O Z317024962 [0,1,0,0,0,0|3,0,0]=4 48 B8R0.23 C=C(CC(=O)O)C(=O)O Z57127539 [0,1,0,0,0,0|3,0,0]=4 49 B8R0.23 C=C(Cl)CC(N)C(=O)O Z2689845474 [0,1,0,0,0,0|3,0,0]=4 50 B8R0.23 CC(=O)N(C)CC(=O)O Z85895184 [0,1,0,0,0,0|2,0,1]=4 51 B8R0.23 CC(=O)NC(C)C(=O)O Z104483794 [0,1,0,0,0,0|2,0,1]=4 52 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Z98655371 [0,1,0,0,0,0|2,0,1]=4 53 B8R0.23 CC(=O)N[C@H](C)C(=O)O Z829930658 [0,1,0,0,0,0|2,0,1]=4 54 B8R0.23 CC(CC(=O)N)C(=O)O Z1203581899 [0,1,0,0,0,0|2,0,0]=3 55 B8R0.23 CC(CC(=O)O)C(=O)N Z1203579878 [0,1,0,0,0,0|2,0,0]=3 56 B8R0.23 CC(N)CC(C)C(=O)O Z5272192378 [0,1,0,0,0,0|2,0,1]=4 57 B8R0.23 CC(NC(=O)N)C(=O)O Z56858169 [0,1,0,0,0,0|1,0,1]=3 58 B8R0.23 CN(CC(=O)O)C(=N)N Z1203577925 [0,1,0,0,0,0|0,0,2]=3 59 B8R0.23 CN(CC(=O)O)C(=O)N Z126513734 [0,1,0,0,0,0|1,0,1]=3 60 B8R0.23 NC(=O)CC(N)C(=O)O Z104481196 [0,1,0,0,0,0|2,0,0]=3 61 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Z1147451758 [0,1,0,0,0,0|2,0,0]=3 62 B8R0.23 NC(=O)C[C@H](N)C(=O)O Z1066276474 [0,1,0,0,0,0|2,0,0]=3 63 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Z1198149443 [0,1,0,0,0,0|2,0,0]=3 64 B8R0.23 NC(CC(=O)O)C(=O)O Z104474760 [0,1,0,0,0,0|3,0,0]=4 65 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Z995084132 [0,1,0,0,0,0|3,0,0]=4 66 B8R0.23 N[C@H](CC(=O)O)C(=O)O Z1079451886 [0,1,0,0,0,0|3,0,0]=4 67 B8R0.23 O=C(O)CC(=O)C(=O)O Z271128590 [0,1,0,0,0,0|3,0,0]=4 68 B8R0.23 O=C(O)CC(O)C(=O)O Z104473230 [0,1,0,0,0,0|3,0,0]=4 69 B8R0.23 O=C(O)CC(S)C(=O)O Z104478826 [0,1,0,0,0,0|3,0,0]=4 70 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Z1205493568 [0,1,0,0,0,0|3,0,0]=4 71 B8R0.23 O=C(O)C[C@H](O)C(=O)O Z1201618618 [0,1,0,0,0,0|3,0,0]=4 72 B8R0.29 CC(C)(N)CCC(=O)O Z1259041013 [0,1,0,0,0,0|2,0,1]=4 73 B8R0.29 NS(=O)(=O)CCC(=O)O Z327222556 [0,1,0,0,0,0|3,0,0]=4 74 B8R0.29 NS(=O)(=O)NCC(=O)O Z295879318 [0,1,0,0,0,0|2,0,1]=4 75 B8R1.3 CC1CN=C(NC1)N Z1203586632 [0,0,0,1,0,0|2,0,1]=4 76 B8R1.3 NC1=NC=C(C=N1)O Z1198175903 [0,0,0,1,0,0|1,0,2]=4 77 B8R1.3 NC1=NNC(=O)C=C1 Z1723418911 [0,0,0,1,0,0|3,0,0]=4 78 B8R1.3 O=C1CCC(=O)NC1 Z1198221828 [0,0,0,1,0,0|3,0,0]=4 79 B8R1.3 O=C1COC(=O)CO1 Z1201618919 [0,0,0,1,0,0|3,0,0]=4 80 B8R1.23 NC(=O)C1CC(=O)C1 Z1486002682 [0,0,0,1,0,0|3,0,0]=4 81 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O Z360056576 [0,0,0,1,0,0|2,0,1]=4 82 B8R1.23 O=C1CC(C1)C(=O)O Z235344247 [0,0,0,1,0,0|3,0,0]=4 83 B8R1.51 CC1(CN=C(N1)N)C Z1262644333 [0,0,0,1,0,0|2,0,1]=4 84 B6R0.2 C/C(=C/C(=O)O)/I Z1508917269 [0,0,0,0,1,0|2,0,1]=4 85 B6R0.2 C=C(C)CC(=O)O Z295890066 [0,0,0,0,1,0|2,0,0]=3 86 B6R0.2 CC(=CC(=O)O)C Z104480144 [0,0,0,0,1,0|2,0,1]=4 87 B6R0.2 CC(=O)/C=C(/C)\N Z56858245 [0,0,0,0,1,0|2,0,1]=4 88 B6R0.2 CC(=O)CC(C)N Z57329385 [0,0,0,0,1,0|2,0,1]=4 89 B6R0.2 CC(=O)NC(=N)N Z1203578060 [0,0,0,0,1,0|1,0,2]=4 90 B6R0.2 CC(=O)NC(=O)N Z104476284 [0,0,0,0,1,0|2,0,1]=4 91 B6R0.2 CC(C)CC(=O)O Z104474910 [0,0,0,0,1,0|2,0,1]=4 92 B6R0.2 CC(N)CC(=O)N Z594220690 [0,0,0,0,1,0|2,0,1]=4 93 B6R0.2 CC(N)CC(=O)O Z147647144 [0,0,0,0,1,0|1,0,1]=3 94 B6R0.2 CN(C)CC(=O)O Z235580496 [0,0,0,0,1,0|3,0,0]=4 95 B6R0.2 CS(=O)CC(=O)N Z1203581973 [0,0,0,0,1,0|3,0,0]=4 96 B6R0.2 C[C@H](N)CC(=O)O Z1741969208 [0,0,0,0,1,0|1,0,1]=3 97 B6R0.2 N=C(N)CC(=N)N Z1357774279 [0,0,0,0,1,0|2,0,1]=4 98 B6R0.2 N=C(N)CC(=O)N Z104480060 [0,0,0,0,1,0|1,0,1]=3 99 B6R0.2 NC(=O)CC(=O)N Z104473780 [0,0,0,0,1,0|2,0,0]=3 100 B6R0.2 NC(=O)CC(=O)O Z963467736 [0,0,0,0,1,0|1,0,0]=2 101 B6R0.2 NC(=O)NC(=O)N Z57206006 [0,0,0,0,1,0|2,0,1]=4 102 B6R0.2 O=C(O)C=C(Br)Br Z1416198234 [0,0,0,0,1,0|2,0,1]=4 103 B6R0.2 O=C(O)C=C(Cl)Cl Z1205493743 [0,0,0,0,1,0|2,0,1]=4 104 B6R0.2 O=C(O)CC(=O)O Z57965450 [0,0,0,0,1,0|2,0,0]=3 105 B8R0.28 CC(=CCCC(=O)O)C Z1198162635 [0,0,0,0,0,1|3,0,0]=4 106 B8R0.28 CC(=O)CCCC(=O)O Z147652222 [0,0,0,0,0,1|3,0,0]=4 107 B8R0.28 CC(=O)NCCC(=O)O Z56886421 [0,0,0,0,0,1|2,0,1]=4 108 B8R0.28 CC(=O)OCCC(=O)O Z216124300 [0,0,0,0,0,1|3,0,0]=4 109 B8R0.28 CC(N)CCCC(=O)O Z1551469174 [0,0,0,0,0,1|2,0,1]=4 110 B8R0.28 CC(N)COCC(=O)O Z3789755599 [0,0,0,0,0,1|2,0,1]=4 111 B8R0.28 N=C(N)NCCC(=O)O Z959165114 [0,0,0,0,0,1|0,0,2]=3 112 B8R0.28 NC(=O)CCCC(=O)O Z336080698 [0,0,0,0,0,1|2,0,0]=3 113 B8R0.28 NC(=O)CNCC(=O)N Z162774608 [0,0,0,0,0,1|2,0,1]=4 114 B8R0.28 NC(=O)CNCC(=O)O Z4658099947 [0,0,0,0,0,1|1,0,1]=3 115 B8R0.28 NC(=O)CSCC(=O)O Z19691778 [0,0,0,0,0,1|2,0,0]=3 116 B8R0.28 NC(=O)NCCC(=O)O Z56347556 [0,0,0,0,0,1|1,0,1]=3 117 B8R0.28 O=C(O)CCCC(=O)O Z57127454 [0,0,0,0,0,1|3,0,0]=4 118 B8R0.28 O=C(O)CNCC(=O)O Z104476528 [0,0,0,0,0,1|2,0,1]=4 119 B8R0.28 O=C(O)COCC(=O)O Z57965384 [0,0,0,0,0,1|3,0,0]=4 120 B8R0.28 O=C(O)CSCC(=O)O Z104478584 [0,0,0,0,0,1|3,0,0]=4 121 B5R0.1 C#CCC(=O)O Z295890060 [2,0,0,0,0,0|1,0,1]=4 122 B5R0.1 C/C=C/C(=O)O Z104476026 [2,0,0,0,0,0|1,0,1]=4 123 B5R0.1 CCCC(=O)O Z104495380 [2,0,0,0,0,0|1,0,1]=4 124 B5R0.1 CNCC(=O)O Z104480276 [2,0,0,0,0,0|0,0,2]=4 125 B5R0.1 COCC(=O)O Z104477404 [2,0,0,0,0,0|1,0,1]=4 126 B5R0.1 N#CCC(=O)O Z104476112 [2,0,0,0,0,0|0,0,2]=4 127 B5R0.1 N=C(N)CCO Z1198394167 [2,0,0,0,0,0|0,0,2]=4 128 B5R0.1 N=C(N)NC=O Z1203578554 [2,0,0,0,0,0|0,0,2]=4 129 B5R0.1 NC(=O)CCO Z431951940 [2,0,0,0,0,0|1,0,1]=4 130 B5R0.1 NCCC(=O)N Z415728050 [2,0,0,0,0,0|1,0,1]=4 131 B5R0.1 NCCC(=O)O Z57127544 [2,0,0,0,0,0|0,0,1]=3 132 B5R0.1 NOCC(=O)O Z90662171 [2,0,0,0,0,0|1,0,0]=3 133 B5R0.1 O=C(O)/C=C/I Z2327124440 [2,0,0,0,0,0|1,0,1]=4 134 B5R0.1 O=C(O)CCCl Z203045320 [2,0,0,0,0,0|1,0,1]=4 135 B5R0.1 O=C(O)CCS Z104474322 [2,0,0,0,0,0|1,0,1]=4 136 B5R0.1 O=C(O)CNO Z1205493750 [2,0,0,0,0,0|1,0,1]=4 137 B7R0.2 CC(CN)CC(=O)O Z1436472873 [1,1,0,0,0,0|1,0,1]=4 138 B7R0.2 NCC(O)CC(=O)O Z1255390571 [1,1,0,0,0,0|1,0,1]=4 139 B7R0.2 NC[C@@H](O)CC(=O)O Z1203578293 [1,1,0,0,0,0|1,0,1]=4 140 B7R0.2 NC[C@H](O)CC(=O)O Z1198160294 [1,1,0,0,0,0|1,0,1]=4 141 B7R0.3 NCCCC(=O)NO Z3488307998 [1,1,0,0,0,0|1,0,1]=4 142 B7R0.4 C=CCCCC(=O)O Z1205493561 [1,1,0,0,0,0|2,0,0]=4 143 B7R0.4 C=CCNCC(=O)O Z803145546 [1,1,0,0,0,0|1,0,1]=4 144 B7R0.4 C=CCOCC(=O)O Z362807794 [1,1,0,0,0,0|2,0,0]=4 145 B7R0.4 C=CCSCC(=O)O Z149151274 [1,1,0,0,0,0|2,0,0]=4 146 B7R0.4 CNCCCC(=O)O Z57043473 [1,1,0,0,0,0|1,0,1]=4 147 B7R0.4 NCCCCC(=O)O Z271111992 [1,1,0,0,0,0|1,0,1]=4 148 B7R0.4 NCCNCC(=O)O Z2692249907 [1,1,0,0,0,0|0,0,2]=4 149 B7R0.4 NCCOCC(=O)O Z1650039500 [1,1,0,0,0,0|1,0,1]=4 150 B7R0.4 NCCSCC(=O)O Z1381287295 [1,1,0,0,0,0|1,0,1]=4 151 B7R0.5 C/C=C/C(O)C(=O)O Z2515207189 [1,1,0,0,0,0|2,0,0]=4 152 B7R0.5 C=CCC(N)C(=O)O Z317024964 [1,1,0,0,0,0|2,0,0]=4 153 B7R0.5 C=CC[C@@H](N)C(=O)O Z1374884973 [1,1,0,0,0,0|2,0,0]=4 154 B7R0.5 CC(CCN)C(=O)O Z2298167292 [1,1,0,0,0,0|1,0,1]=4 155 B7R0.5 CC(NC=O)C(=O)O Z56757230 [1,1,0,0,0,0|1,0,1]=4 156 B7R0.5 NCCC(F)C(=O)O Z3235903750 [1,1,0,0,0,0|1,0,1]=4 157 B7R0.5 NCC[C@H](N)C(=O)O Z1741978716 [1,1,0,0,0,0|1,0,1]=4 158 B7R0.5 NCC[C@H](O)C(=O)O Z1203578154 [1,1,0,0,0,0|1,0,1]=4 159 B7R0.9 CC(C)(N)CC(=O)O Z1255523279 [0,1,0,0,1,0|1,0,1]=4 160 B7R0.9 NS(=O)(=O)CC(=O)O Z331472332 [0,1,0,0,1,0|2,0,0]=4 161 B7R0.16 CC(C(=O)N)C(=O)N Z1203578231 [0,1,0,0,1,0|2,0,0]=4 162 B7R0.16 CC(C(=O)O)C(=O)O Z787653408 [0,1,0,0,1,0|2,0,0]=4 163 B7R0.16 CC(N)C(C)C(=O)O Z1198162847 [0,1,0,0,1,0|1,0,1]=4 164 B7R0.16 NC(=O)C(N)C(=O)N Z235333079 [0,1,0,0,1,0|2,0,0]=4 165 B7R0.16 O=C(O)C(O)C(=O)O Z90123595 [0,1,0,0,1,0|2,0,0]=4 166 B9R0.7 NC(=O)CCC(N)C(=O)O Z104497332 [0,1,0,0,0,1|2,0,0]=4 167 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O Z1203578189 [0,1,0,0,0,1|2,0,0]=4 168 B9R0.7 NC(=O)CC[C@H](N)C(=O)O Z756440074 [0,1,0,0,0,1|2,0,0]=4 169 B9R0.53 CC(CC(=O)O)NC(=O)N Z398943198 [0,1,0,0,0,1|1,0,1]=4 170 B9R0.24 COC(=O)CCC(=O)CN Z3015912776 [0,2,0,0,0,0|2,0,0]=4 171 B9R0.42 CNC(=O)NC(C)C(=O)O Z223131756 [0,2,0,0,0,0|1,0,1]=4 172 B9R0.48 CCNC(=O)CCC(=O)O Z90312637 [0,2,0,0,0,0|2,0,0]=4 173 B9R0.48 NCCC(=O)NCC(=O)O Z1901071297 [0,2,0,0,0,0|1,0,1]=4 174 B9R0.39 CCC(NC(=O)N)C(=O)O Z90663559 [0,2,0,0,0,0|1,0,1]=4 175 B9R0.39 N=C(N)NC(CS)C(=O)O Z1262518379 [0,2,0,0,0,0|0,0,2]=4 176 B9R0.39 NC(=O)NC(CO)C(=O)O Z57009601 [0,2,0,0,0,0|1,0,1]=4 177 B7R1.2 CC1=CN=C(O1)N Z994267654 [1,0,0,1,0,0|1,0,1]=4 178 B7R1.2 CC1=NN=C(N1)N Z951367902 [1,0,0,1,0,0|2,0,0]=4 179 B7R1.2 CC1=NN=C(O1)N Z56957510 [1,0,0,1,0,0|2,0,0]=4 180 B7R1.2 CC1=NNC(=O)O1 Z1198174319 [1,0,0,1,0,0|2,0,0]=4 181 B7R1.2 CC1CN=C(N1)N Z1642389934 [1,0,0,1,0,0|1,0,1]=4 182 B7R1.2 CC1CN=C(O1)N Z1203579428 [1,0,0,1,0,0|1,0,1]=4 183 B7R1.2 NC1=CC(=O)CC1 Z1124125496 [1,0,0,1,0,0|2,0,0]=4 184 B7R1.2 NC1=CCC(=O)N1 Z1203591710 [1,0,0,1,0,0|1,0,0]=3 185 B7R1.2 NC1=NC(=O)CS1 Z57104428 [1,0,0,1,0,0|1,0,1]=4 186 B7R1.2 NC1=NCC(=O)N1 Z203038534 [1,0,0,1,0,0|0,0,0]=2 187 B7R1.2 NC1=NN=C(N1)O Z1869802420 [1,0,0,1,0,0|1,0,0]=3 188 B7R1.2 NC1=NN=C(S1)O Z1824511386 [1,0,0,1,0,0|1,1,0]=4 189 B7R1.2 O=C1CCC(=O)N1 Z57127349 [1,0,0,1,0,0|2,0,0]=4 190 B7R1.2 O=C1CCC(=O)O1 Z57127506 [1,0,0,1,0,0|2,0,0]=4 191 B7R1.2 O=C1CNC(=O)N1 Z57131035 [1,0,0,1,0,0|1,0,1]=4 192 B7R1.2 O=C1CNC(=S)N1 Z56900799 [1,0,0,1,0,0|1,0,1]=4 193 B7R1.2 O=C1COC(=O)N1 Z56762271 [1,0,0,1,0,0|2,0,0]=4 194 B7R1.2 O=C1CSC(=O)N1 Z57131032 [1,0,0,1,0,0|2,0,0]=4 195 B7R1.2 O=C1CSC(=S)N1 Z57127468 [1,0,0,1,0,0|2,0,0]=4 196 B7R1.3 NC1=NCCCN1 Z1259041088 [1,0,0,1,0,0|1,0,1]=4 197 B7R1.18 O=C(O)C1CCN1 Z168878270 [1,0,0,1,0,0|1,0,1]=4 198 B7R1.20 NC(=NC1CC1)N Z1815149162 [1,0,0,1,0,0|1,0,1]=4 199 B9R1.35 CC(=O)C1=CN=C(N1)N Z1198276815 [0,0,0,1,0,1|1,0,1]=4 200 B9R1.35 CC1=NOC(C1)C(=O)O Z1198309057 [0,0,0,1,0,1|2,0,0]=4 201 B9R1.35 NC1=NC=C(O1)C(=O)O Z1198322955 [0,0,0,1,0,1|1,0,1]=4 202 B9R1.35 NC1=NNC(=C1)C(=O)O Z275170588 [0,0,0,1,0,1|1,0,1]=4 203 B9R1.35 NC1=NNC(=N1)C(=O)O Z56922164 [0,0,0,1,0,1|0,0,2]=4 204 B9R1.35 O=C1CCC(N1)C(=O)O Z104474096 [0,0,0,1,0,1|2,0,0]=4 205 B9R1.35 O=C1CC[C@@H](N1)C(=O)O Z812534840 [0,0,0,1,0,1|2,0,0]=4 206 B9R1.35 O=C1CC[C@H](N1)C(=O)O Z1154378309 [0,0,0,1,0,1|2,0,0]=4 207 B9R1.35 O=C1NC(CO1)C(=O)O Z1201627960 [0,0,0,1,0,1|2,0,0]=4 208 B9R1.35 O=C1NC(CS1)C(=O)O Z199409846 [0,0,0,1,0,1|2,0,0]=4 209 B9R1.35 O=C1NCC(N1)C(=O)O Z1162470818 [0,0,0,1,0,1|1,0,1]=4 210 B9R1.35 O=C1N[C@@H](CS1)C(=O)O Z203038562 [0,0,0,1,0,1|2,0,0]=4 211 B9R1.161 NC(=O)[C@@H]1C[C@@H]1C(=O)O Z1955831192 [0,0,0,1,0,1|2,0,0]=4 212 B9R1.69 CC1=NN=C(NC1=O)N Z1198160530 [0,1,0,1,0,0|2,0,0]=4 213 B9R1.69 NC1=NC=C(C(=O)N1)I Z1272073698 [0,1,0,1,0,0|1,0,1]=4 214 B9R1.82 COC(=O)[C@@H]1CC(=O)N1 Z1198222336 [0,1,0,1,0,0|2,0,0]=4 215 B5R0.5 C=C(Cl)C(=O)O Z1201617183 [0,0,0,0,2,0|2,0,0]=4 216 B5R0.5 CC(=O)C(=O)O Z104495240 [0,0,0,0,2,0|2,0,0]=4 217 B5R0.5 CC(N)C(=O)O Z57396987 [0,0,0,0,2,0|1,0,1]=4 218 B5R0.5 C[C@@H](N)C(=O)O Z802692914 [0,0,0,0,2,0|1,0,1]=4 219 B5R0.5 C[C@H](N)C(=O)O Z756424912 [0,0,0,0,2,0|1,0,1]=4 220 B5R0.5 O=C(O)C(=O)O Z1741978903 [0,0,0,0,2,0|2,0,0]=4 221 B9R0.55 CC(=NOCCC(=O)O)C Z1205494264 [0,0,0,0,0,2|2,0,0]=4 222 B9R0.55 NC(=O)CCCCC(=O)O Z429601664 [0,0,0,0,0,2|2,0,0]=4 223 B9R0.55 NC(=O)CSCCC(=O)O Z17834964 [0,0,0,0,0,2|2,0,0]=4 224 B9R0.55 NC(=O)NCCCC(=O)O Z56912008 [0,0,0,0,0,2|1,0,1]=4