0 B7R0.3 C#CC(=O)NCCN Z3038435158 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.3 C#CCNC(=O)CC Z220957516 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.3 C#CCNC(=O)CCl Z147651658 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.3 C#CCNC(=O)CN Z1262250790 [0,0,0,0,0,0|2,0,1]=3 4 B7R0.3 C#CCOC(=O)CN Z3401786508 [0,0,0,0,0,0|1,0,1]=2 5 B7R0.3 C=CCNC(=O)CCl Z56899047 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.3 CC(CN)CCCO Z2234185702 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.3 CCC(=O)NCCN Z1455674775 [0,0,0,0,0,0|3,0,0]=3 8 B7R0.3 CCC(C)NCCO Z335251014 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.3 CCCCC(=O)CC Z406378226 [0,0,0,0,0,0|3,0,0]=3 10 B7R0.3 CCCCC(N)CN Z756921038 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.3 CCCNC(=O)CC Z33030426 [0,0,0,0,0,0|3,0,0]=3 12 B7R0.3 CCCNC(=S)NN Z56985754 [0,0,0,0,0,0|3,1,0]=4 13 B7R0.3 CNC(=O)CCCN Z451350656 [0,0,0,0,0,0|4,0,0]=4 14 B7R0.3 CNC(=O)NCCO Z177090556 [0,0,0,0,0,0|3,0,0]=3 15 B7R0.3 CNC(=O)OCCO Z1198150357 [0,0,0,0,0,0|2,0,0]=2 16 B7R0.3 COC(=O)NCCN Z2237317343 [0,0,0,0,0,0|4,0,0]=4 17 B7R0.3 N#CCNC(=O)CCl Z258588590 [0,0,0,0,0,0|3,0,1]=4 18 B7R0.3 NCC(=O)NCCO Z401366912 [0,0,0,0,0,0|1,0,0]=1 19 B7R0.3 NCCCC(=O)NO Z3488307998 [0,0,0,0,0,0|4,0,0]=4 20 B7R0.3 O=C(CO)NCCO Z1203732626 [0,0,0,0,0,0|2,0,0]=2 21 B6R0.1 C#CC(=O)OCC Z104478880 [1,0,0,0,0,0|1,0,1]=3 22 B6R0.1 CC(CN)CCO Z1203581915 [1,0,0,0,0,0|1,0,1]=3 23 B6R0.1 CCC(=O)COC Z825742020 [1,0,0,0,0,0|3,0,0]=4 24 B6R0.1 CCC(N)CCO Z1258578227 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.1 CCC(O)CCO Z1198157972 [1,0,0,0,0,0|1,0,2]=4 26 B6R0.1 CCCC(=O)CN Z1203579017 [1,0,0,0,0,0|1,0,0]=2 27 B6R0.1 CCCC(=O)NO Z59181937 [1,0,0,0,0,0|3,0,0]=4 28 B6R0.1 CCCC(N)CN Z425861040 [1,0,0,0,0,0|2,0,1]=4 29 B6R0.1 CCCC(O)CN Z419084742 [1,0,0,0,0,0|1,0,2]=4 30 B6R0.1 CCNC(=O)CN Z54747476 [1,0,0,0,0,0|1,0,0]=2 31 B6R0.1 CCNC(=O)CO Z431952024 [1,0,0,0,0,0|2,0,0]=3 32 B6R0.1 CCNC(=S)NN Z56965890 [1,0,0,0,0,0|2,1,0]=4 33 B6R0.1 CCOC(=N)CC Z3033961910 [1,0,0,0,0,0|2,0,0]=3 34 B6R0.1 CCOC(=O)CN Z594038186 [1,0,0,0,0,0|0,0,0]=1 35 B6R0.1 CCOC(=O)CO Z385458066 [1,0,0,0,0,0|1,0,0]=2 36 B6R0.1 CCOC(=O)NN Z104478458 [1,0,0,0,0,0|1,0,0]=2 37 B6R0.1 CCOC(C)CN Z844631802 [1,0,0,0,0,0|1,0,1]=3 38 B6R0.1 CCS(=O)CCN Z1266854910 [1,0,0,0,0,0|3,0,0]=4 39 B6R0.1 CNC(=O)CCCl Z239813512 [1,0,0,0,0,0|3,0,0]=4 40 B6R0.1 CNC(=O)CCN Z425449754 [1,0,0,0,0,0|3,0,0]=4 41 B6R0.1 CNC(=O)CCO Z975909370 [1,0,0,0,0,0|2,0,0]=3 42 B6R0.1 CONC(=O)CCl Z234816732 [1,0,0,0,0,0|3,0,0]=4 43 B6R0.1 N#CCC(=O)NN Z104474618 [1,0,0,0,0,0|2,0,1]=4 44 B6R0.1 NCC[C@H](F)CN Z4607150940 [1,0,0,0,0,0|2,0,1]=4 45 B6R0.4 C#CCNC(=O)C Z220957448 [1,0,0,0,0,0|2,0,1]=4 46 B6R0.4 C#CCNC(=O)N Z198194920 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.4 C#CCOC(=O)N Z1203578973 [1,0,0,0,0,0|1,0,1]=3 48 B6R0.4 C=CCCC(=O)C Z406376894 [1,0,0,0,0,0|2,0,1]=4 49 B6R0.4 C=CCNC(=O)C Z32064466 [1,0,0,0,0,0|2,0,1]=4 50 B6R0.4 C=CCNC(=O)N Z56904662 [1,0,0,0,0,0|2,0,1]=4 51 B6R0.4 CC(=O)CCC#N Z1251352415 [1,0,0,0,0,0|2,0,1]=4 52 B6R0.4 CC(=O)NCCCl Z57983106 [1,0,0,0,0,0|2,0,0]=3 53 B6R0.4 CC(=O)OCCN Z1973465551 [1,0,0,0,0,0|1,0,0]=2 54 B6R0.4 CC(C)NCCO Z137800940 [1,0,0,0,0,0|2,0,1]=4 55 B6R0.4 CC(C)OCCN Z1688198421 [1,0,0,0,0,0|2,0,1]=4 56 B6R0.4 CC(C)OCCO Z104478444 [1,0,0,0,0,0|1,0,1]=3 57 B6R0.4 CC(N)CCCO Z1203578676 [1,0,0,0,0,0|2,0,1]=4 58 B6R0.4 CCCCC(=N)N Z1723418909 [1,0,0,0,0,0|3,0,0]=4 59 B6R0.4 CCCCC(=O)N Z104476278 [1,0,0,0,0,0|2,0,0]=3 60 B6R0.4 CCCCC(=O)O Z104473312 [1,0,0,0,0,0|3,0,0]=4 61 B6R0.4 CCCNC(=O)C Z33030314 [1,0,0,0,0,0|2,0,0]=3 62 B6R0.4 CCCNC(=S)N Z56930715 [1,0,0,0,0,0|2,1,0]=4 63 B6R0.4 CCCOC(=O)N Z1198148877 [1,0,0,0,0,0|1,0,0]=2 64 B6R0.4 CCNCC(=O)N Z1459435506 [1,0,0,0,0,0|3,0,0]=4 65 B6R0.4 CNCCC(=O)C Z1536943318 [1,0,0,0,0,0|3,0,0]=4 66 B6R0.4 COCCC(=O)C Z362119682 [1,0,0,0,0,0|3,0,0]=4 67 B6R0.4 COCCC(=O)N Z394696458 [1,0,0,0,0,0|3,0,0]=4 68 B6R0.4 N#CCCC(=O)N Z57160408 [1,0,0,0,0,0|2,0,1]=4 69 B6R0.4 N#CCNC(=O)N Z600498544 [1,0,0,0,0,0|2,0,1]=4 70 B6R0.4 N=C(N)NCCN Z2235813444 [1,0,0,0,0,0|3,0,0]=4 71 B6R0.4 N=C(N)NCCO Z911465228 [1,0,0,0,0,0|2,0,0]=3 72 B6R0.4 N=C(N)SCCO Z57111959 [1,0,0,0,0,0|1,1,0]=3 73 B6R0.4 NC(=O)CCCO Z1203578394 [1,0,0,0,0,0|1,0,0]=2 74 B6R0.4 NC(=O)NCCF Z1203582184 [1,0,0,0,0,0|2,0,0]=3 75 B6R0.4 NC(=O)OCCO Z1198158440 [1,0,0,0,0,0|0,0,0]=1 76 B6R0.4 NCCCC(=O)N Z398513418 [1,0,0,0,0,0|2,0,0]=3 77 B6R0.4 NCCCC(=O)O Z104475620 [1,0,0,0,0,0|3,0,0]=4 78 B6R0.4 NCCNC(=O)N Z1268152381 [1,0,0,0,0,0|2,0,0]=3 79 B6R0.4 NCCOC(=O)N Z1587257433 [1,0,0,0,0,0|1,0,0]=2 80 B6R0.4 O=C(O)/C=C/CO Z3178016098 [1,0,0,0,0,0|2,0,1]=4 81 B6R0.4 O=C(O)C#CCO Z1198169479 [1,0,0,0,0,0|2,0,1]=4 82 B6R0.4 O=C(O)CCCS Z147642510 [1,0,0,0,0,0|2,1,0]=4 83 B6R0.6 C=CCOCCN Z976678988 [1,0,0,0,0,0|1,0,2]=4 84 B6R0.6 CCCCCCO Z104473568 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.6 CCCOCCN Z4449042604 [1,0,0,0,0,0|1,0,1]=3 86 B6R0.6 CCNCCCO Z138139914 [1,0,0,0,0,0|3,0,0]=4 87 B6R0.6 CCOCCCO Z1080358490 [1,0,0,0,0,0|3,0,0]=4 88 B6R0.6 NCC#CCCO Z1203639371 [1,0,0,0,0,0|1,0,1]=3 89 B6R0.6 NCCC#CCO Z4947584692 [1,0,0,0,0,0|1,0,2]=4 90 B6R0.6 NCCCCCF Z3524160733 [1,0,0,0,0,0|2,0,1]=4 91 B6R0.6 NCCCCCN Z951173830 [1,0,0,0,0,0|2,0,1]=4 92 B6R0.6 NCCNCCN Z104475186 [1,0,0,0,0,0|2,0,1]=4 93 B6R0.6 OCCNCCO Z104475196 [1,0,0,0,0,0|2,0,1]=4 94 B8R0.1 C#CCNC(=O)CCN Z4191042568 [0,1,0,0,0,0|2,0,1]=4 95 B8R0.1 C=CCOC(=O)CC#N Z56896765 [0,1,0,0,0,0|1,0,2]=4 96 B8R0.1 CCCNC(=O)CC#N Z169918900 [0,1,0,0,0,0|2,0,1]=4 97 B8R0.1 CCCNC(=O)CNC Z56979317 [0,1,0,0,0,0|2,0,0]=3 98 B8R0.1 CCCOC(=O)OCC Z2375631176 [0,1,0,0,0,0|2,0,0]=3 99 B8R0.1 CCNC(=O)NCCN Z2205958434 [0,1,0,0,0,0|3,0,0]=4 100 B8R0.1 CCNC(=O)NCCO Z425745170 [0,1,0,0,0,0|2,0,0]=3 101 B8R0.1 CCOC(=O)NCCN Z1263820337 [0,1,0,0,0,0|3,0,0]=4 102 B8R0.1 CCOC(=O)NCCO Z31725113 [0,1,0,0,0,0|2,0,0]=3 103 B8R0.1 N#CCC(=O)NCCO Z57906863 [0,1,0,0,0,0|1,0,1]=3 104 B8R0.3 CCCC(C)C(=O)CC Z1138187109 [0,1,0,0,0,0|3,0,0]=4 105 B8R0.3 COC(=O)N(C)CCO Z371625398 [0,1,0,0,0,0|3,0,0]=4 106 B8R0.6 CCCCNC(=O)CCl Z56853747 [0,1,0,0,0,0|3,0,0]=4 107 B8R0.6 CCCCOC(=O)CN Z1266823221 [0,1,0,0,0,0|1,0,0]=2 108 B8R0.6 CCCCOC(=O)OC Z1238573230 [0,1,0,0,0,0|3,0,0]=4 109 B8R0.6 CNC(=O)COCCN Z1457935024 [0,1,0,0,0,0|3,0,0]=4 110 B8R0.6 CNC(=O)NCCCO Z177090148 [0,1,0,0,0,0|3,0,0]=4 111 B8R0.6 CNC(=O)OCCCN Z3465972444 [0,1,0,0,0,0|3,0,0]=4 112 B8R0.6 COCCNC(=O)CCl Z56887684 [0,1,0,0,0,0|2,0,0]=3 113 B8R0.6 COCCNC(=S)NN Z56837099 [0,1,0,0,0,0|2,1,0]=4 114 B8R0.8 CC(N)C(=O)NCCF Z1992147476 [0,1,0,0,0,0|2,0,0]=3 115 B8R0.8 CC(N)C(=O)NCCN Z1080379186 [0,1,0,0,0,0|2,0,0]=3 116 B8R0.8 CCCNC(=O)C(C)Cl Z147652134 [0,1,0,0,0,0|3,0,0]=4 117 B8R0.8 CCCNC(=O)C(C)N Z89265000 [0,1,0,0,0,0|2,0,0]=3 118 B8R0.8 CN(C)C(=O)CCCO Z839108358 [0,1,0,0,0,0|3,0,0]=4 119 B8R0.8 CN(C)C(=O)NCCO Z208334210 [0,1,0,0,0,0|3,0,0]=4 120 B8R0.8 CN(C)C(=O)OCCN Z2517220618 [0,1,0,0,0,0|3,0,0]=4 121 B8R0.8 C[C@H](N)C(=O)NCCO Z1398462031 [0,1,0,0,0,0|1,0,0]=2 122 B8R0.9 CC(C)CNC(=O)CCl Z56887734 [0,1,0,0,0,0|3,0,0]=4 123 B8R0.9 CC(C)CNC(=O)CN Z1262246246 [0,1,0,0,0,0|2,0,0]=3 124 B8R0.9 CCC(=O)CCC(=O)O Z838955680 [0,1,0,0,0,0|2,0,1]=4 125 B8R0.9 CCC(=O)NCC(=O)O Z85886715 [0,1,0,0,0,0|2,0,1]=4 126 B8R0.9 NCC(=O)CCC(=O)O Z1741972992 [0,1,0,0,0,0|1,0,1]=3 127 B8R0.9 NCC(=O)NCC(=O)O Z56896934 [0,1,0,0,0,0|1,0,1]=3 128 B8R0.19 CC(CO)OC(C)CO Z1198222881 [0,1,0,0,0,0|2,0,1]=4 129 B8R0.19 CCC(C)NC(=O)CCl Z56853748 [0,1,0,0,0,0|3,0,0]=4 130 B8R0.25 CC(C)(CN)CCCO Z1251362804 [0,1,0,0,0,0|2,0,1]=4 131 B8R0.25 CC(C)(CN)OCCO Z4912053140 [0,1,0,0,0,0|1,0,1]=3 132 B8R1.1 CCC1CCC(=O)N1 Z1203731077 [0,0,0,1,0,0|3,0,0]=4 133 B8R1.1 NCC1CCC(=O)N1 Z1171481666 [0,0,0,1,0,0|3,0,0]=4 134 B8R1.1 NCC1CCC(=O)O1 Z1262632907 [0,0,0,1,0,0|2,0,0]=3 135 B8R1.1 NCC1CNC(=O)O1 Z2028214442 [0,0,0,1,0,0|3,0,0]=4 136 B8R1.1 NCC1COC(=O)O1 Z3474887077 [0,0,0,1,0,0|3,0,0]=4 137 B8R1.1 NC[C@H]1COC(=O)O1 Z3951135907 [0,0,0,1,0,0|3,0,0]=4 138 B8R1.1 O=C1CC(CN1)CO Z1201625841 [0,0,0,1,0,0|3,0,0]=4 139 B8R1.1 O=C1CCC(N1)CO Z235344363 [0,0,0,1,0,0|2,0,0]=3 140 B8R1.1 O=C1CC[C@H](N1)CO Z235344345 [0,0,0,1,0,0|2,0,0]=3 141 B8R1.1 O=C1NCC(O1)CCl Z56346848 [0,0,0,1,0,0|3,0,0]=4 142 B8R1.1 O=C1N[C@H](CO1)CO Z1203731623 [0,0,0,1,0,0|3,0,0]=4 143 B8R1.1 OCC1CC(CN1)F Z1753033006 [0,0,0,1,0,0|2,0,1]=4 144 B8R1.2 NCC1=CCCCC1 Z2230911155 [0,0,0,1,0,0|3,0,0]=4 145 B8R1.2 NCC1=CCCOC1 Z2096659348 [0,0,0,1,0,0|2,0,0]=3 146 B8R1.2 NCC1=COCCO1 Z425641798 [0,0,0,1,0,0|1,0,0]=2 147 B8R1.2 NCC1=NCCCN1 Z994488026 [0,0,0,1,0,0|3,0,0]=4 148 B8R1.2 NCC1CCCCO1 Z839575544 [0,0,0,1,0,0|2,0,1]=4 149 B8R1.2 NCC1COCCN1 Z2768165249 [0,0,0,1,0,0|2,0,1]=4 150 B8R1.2 O=CC1=COCCO1 Z1198154290 [0,0,0,1,0,0|2,0,1]=4 151 B8R1.2 OCC1=COCCO1 Z1101443027 [0,0,0,1,0,0|2,0,0]=3 152 B8R1.2 OCC1COCCO1 Z1020816972 [0,0,0,1,0,0|2,0,1]=4 153 B8R1.3 CC1CCC(=O)CC1 Z57073963 [0,0,0,1,0,0|3,0,0]=4 154 B8R1.3 CC1CCC(=O)NC1 Z969194082 [0,0,0,1,0,0|3,0,0]=4 155 B8R1.3 CC1CCC(CO1)O Z1898581838 [0,0,0,1,0,0|2,0,1]=4 156 B8R1.3 CC1COC(CN1)C Z327218388 [0,0,0,1,0,0|2,0,1]=4 157 B8R1.3 NC1CCC(=O)CC1 Z1198169628 [0,0,0,1,0,0|3,0,0]=4 158 B8R1.3 NC1CCC(=O)NC1 Z992717028 [0,0,0,1,0,0|3,0,0]=4 159 B8R1.3 O=C1CCC(=O)NC1 Z1198221828 [0,0,0,1,0,0|1,0,2]=4 160 B8R1.3 O=C1CNC(=O)CN1 Z56854487 [0,0,0,1,0,0|1,0,2]=4 161 B8R1.3 O=C1COC(=O)CO1 Z1201618919 [0,0,0,1,0,0|1,0,2]=4 162 B8R1.3 O=C1NCC(CN1)O Z1198163621 [0,0,0,1,0,0|3,0,0]=4 163 B8R1.5 CC1CCCCC1=O Z104477192 [0,0,0,1,0,0|3,0,0]=4 164 B8R1.5 CC1CCCNC1=O Z1013766916 [0,0,0,1,0,0|3,0,0]=4 165 B8R1.5 CC1NCCNC1=O Z336079670 [0,0,0,1,0,0|3,0,0]=4 166 B8R1.5 CC1SCCCC1=O Z1359849054 [0,0,0,1,0,0|2,1,0]=4 167 B8R1.5 CC1SCCNC1=O Z1098219156 [0,0,0,1,0,0|2,1,0]=4 168 B8R1.5 NC1CCCCC1=O Z2186882796 [0,0,0,1,0,0|2,0,0]=3 169 B8R1.5 NC1CCCNC1=O Z993991168 [0,0,0,1,0,0|2,0,0]=3 170 B8R1.5 NN1CCCCC1=O Z976663668 [0,0,0,1,0,0|3,0,0]=4 171 B8R1.5 O=C1CCCCC1Cl Z94598693 [0,0,0,1,0,0|3,0,0]=4 172 B8R1.5 O=C1NCCCC1F Z1203749514 [0,0,0,1,0,0|3,0,0]=4 173 B8R1.10 OCCOC1CCC1 Z959313250 [0,0,0,1,0,0|2,0,1]=4 174 B8R1.13 O=C1CCN1CCO Z1897885187 [0,0,0,1,0,0|2,0,0]=3 175 B8R1.22 CC1CNCCCO1 Z425722880 [0,0,0,1,0,0|2,0,1]=4 176 B8R1.22 O=C1CCCCCC1 Z104473100 [0,0,0,1,0,0|3,0,0]=4 177 B8R1.22 O=C1CCNCCN1 Z119989554 [0,0,0,1,0,0|3,0,0]=4 178 B8R1.22 O=C1CCOCCN1 Z821098578 [0,0,0,1,0,0|2,0,0]=3 179 B8R1.22 O=C1CCSCCN1 Z1198315286 [0,0,0,1,0,0|2,1,0]=4 180 B8R1.22 O=C1CNCCCN1 Z2756332573 [0,0,0,1,0,0|2,0,0]=3 181 B8R1.22 O=C1COCCCN1 Z1203733065 [0,0,0,1,0,0|3,0,0]=4 182 B8R1.38 CCC(=O)C1CCC1 Z1251352405 [0,0,0,1,0,0|3,0,0]=4 183 B8R1.38 NCC(=O)C1CCC1 Z2568737813 [0,0,0,1,0,0|2,0,0]=3 184 B8R1.38 O=C(CCl)C1CCC1 Z1238572148 [0,0,0,1,0,0|3,0,0]=4 185 B8R1.38 O=C(CCl)N1CCC1 Z57039583 [0,0,0,1,0,0|3,0,0]=4 186 B8R1.40 COC(=O)CC1CO1 Z2689606459 [0,0,0,1,0,0|3,0,0]=4 187 B8R1.40 NCC(=O)NC1CC1 Z94599161 [0,0,0,1,0,0|2,0,0]=3 188 B8R1.40 O=C(CCl)CC1CC1 Z1386913809 [0,0,0,1,0,0|3,0,0]=4 189 B8R1.40 O=C(CCl)NC1CC1 Z56867231 [0,0,0,1,0,0|3,0,0]=4 190 B8R1.40 O=C(CO)NC1CC1 Z431952008 [0,0,0,1,0,0|3,0,0]=4 191 B8R1.50 CC1CNC(=O)C1C Z1203745887 [0,0,0,1,0,0|3,0,0]=4 192 B8R1.50 CC1COC(=O)C1N Z3951586277 [0,0,0,1,0,0|1,0,0]=2 193 B8R1.50 N[C@H]1C(=O)NC[C@@H]1O Z5183356392 [0,0,0,1,0,0|1,0,0]=2 194 B8R1.52 CC1(CCCO1)CN Z1198218662 [0,0,0,1,0,0|2,0,1]=4 195 B8R1.52 CC1(OCCO1)CN Z1198278649 [0,0,0,1,0,0|1,0,1]=3 196 B8R1.83 CC1CC1C(=O)CCl Z1386913500 [0,0,0,1,0,0|3,0,0]=4 197 B8R1.83 CC1CC1C(=O)NN Z58981971 [0,0,0,1,0,0|3,0,0]=4 198 B8R1.83 CCC(=O)C1CC1C Z1259336402 [0,0,0,1,0,0|3,0,0]=4 199 B5R0.1 C=C(C)CCN Z1203582475 [2,0,0,0,0,0|2,0,0]=4 200 B5R0.1 CC#CC(=O)N Z1203579284 [2,0,0,0,0,0|1,0,1]=4 201 B5R0.1 CC(=O)CCO Z906206900 [2,0,0,0,0,0|0,0,0]=2 202 B5R0.1 CC(C)CCO Z104473558 [2,0,0,0,0,0|1,0,1]=4 203 B5R0.1 CC(N)CCO Z385458430 [2,0,0,0,0,0|1,0,1]=4 204 B5R0.1 CC(O)CCO Z104473530 [2,0,0,0,0,0|0,0,2]=4 205 B5R0.1 CCCC(=N)N Z1198394172 [2,0,0,0,0,0|2,0,0]=4 206 B5R0.1 CCCC(=O)N Z33546461 [2,0,0,0,0,0|1,0,0]=3 207 B5R0.1 CCCC(=O)O Z104495380 [2,0,0,0,0,0|2,0,0]=4 208 B5R0.1 CCNC(=N)N Z2574931373 [2,0,0,0,0,0|2,0,0]=4 209 B5R0.1 CCOC(=N)N Z1741973543 [2,0,0,0,0,0|1,0,0]=3 210 B5R0.1 CCOC(=O)N Z33546369 [2,0,0,0,0,0|0,0,0]=2 211 B5R0.1 CCSC(=N)N Z1708092306 [2,0,0,0,0,0|1,1,0]=4 212 B5R0.1 CN(C)CCO Z104473552 [2,0,0,0,0,0|2,0,0]=4 213 B5R0.1 CNCC(=O)N Z415678308 [2,0,0,0,0,0|2,0,0]=4 214 B5R0.1 COCC(=O)N Z33546778 [2,0,0,0,0,0|2,0,0]=4 215 B5R0.1 CS(=O)CCN Z802568576 [2,0,0,0,0,0|2,0,0]=4 216 B5R0.1 CSCC(=O)N Z33545668 [2,0,0,0,0,0|2,0,0]=4 217 B5R0.1 C[C@@H](N)CCO Z1526453858 [2,0,0,0,0,0|1,0,1]=4 218 B5R0.1 N#CCC(=O)N Z56896153 [2,0,0,0,0,0|1,0,1]=4 219 B5R0.1 N=C(N)CCO Z1198394167 [2,0,0,0,0,0|1,0,0]=3 220 B5R0.1 NC(=O)CCO Z431951940 [2,0,0,0,0,0|0,0,0]=2 221 B5R0.1 NCCC(=O)N Z415728050 [2,0,0,0,0,0|1,0,0]=3 222 B5R0.1 NCCC(=O)O Z57127544 [2,0,0,0,0,0|2,0,0]=4 223 B5R0.1 O=C(O)CCCl Z203045320 [2,0,0,0,0,0|2,0,0]=4 224 B5R0.1 O=C(O)CCS Z104474322 [2,0,0,0,0,0|1,1,0]=4 225 B5R0.1 O=C(O)CNO Z1205493750 [2,0,0,0,0,0|2,0,0]=4 226 B5R0.2 C/C=C/CCN Z1268152372 [2,0,0,0,0,0|2,0,0]=4 227 B5R0.2 C/C=C/OCC Z281777810 [2,0,0,0,0,0|1,0,1]=4 228 B5R0.2 CC#CCCO Z1033337288 [2,0,0,0,0,0|1,0,1]=4 229 B5R0.2 CCC#CCN Z4935566672 [2,0,0,0,0,0|1,0,1]=4 230 B5R0.2 CCCCC=O Z104472992 [2,0,0,0,0,0|2,0,0]=4 231 B5R0.2 CCCCCN Z104472246 [2,0,0,0,0,0|1,0,1]=4 232 B5R0.2 CCNCCO Z1258992395 [2,0,0,0,0,0|1,0,1]=4 233 B5R0.2 CCNOCC Z223690220 [2,0,0,0,0,0|2,0,0]=4 234 B5R0.2 CCOCCN Z271005962 [2,0,0,0,0,0|0,0,1]=3 235 B5R0.2 CCOCCO Z104473122 [2,0,0,0,0,0|0,0,1]=3 236 B5R0.2 CCSCCN Z3061111063 [2,0,0,0,0,0|0,1,1]=4 237 B5R0.2 CNCCCO Z104756980 [2,0,0,0,0,0|2,0,0]=4 238 B5R0.2 COCCCO Z431517702 [2,0,0,0,0,0|2,0,0]=4 239 B5R0.2 NC/C=C/CN Z2235386837 [2,0,0,0,0,0|1,0,1]=4 240 B5R0.2 NCCCCF Z2177031126 [2,0,0,0,0,0|1,0,1]=4 241 B5R0.2 NCCCCN Z104472592 [2,0,0,0,0,0|1,0,1]=4 242 B5R0.2 OC/C=C/CO Z237581088 [2,0,0,0,0,0|1,0,1]=4 243 B5R0.3 C=C(CC)CN Z2238934536 [2,0,0,0,0,0|1,0,0]=3 244 B5R0.3 CC(CN)CO Z406342068 [2,0,0,0,0,0|1,0,1]=4 245 B5R0.3 CCC(=O)CC Z104476878 [2,0,0,0,0,0|1,0,0]=3 246 B5R0.3 CCC(=O)CN Z1203579016 [2,0,0,0,0,0|0,0,0]=2 247 B5R0.3 CCC(=O)NN Z56886418 [2,0,0,0,0,0|1,0,0]=3 248 B5R0.3 CCC(C)CN Z2350903977 [2,0,0,0,0,0|1,0,1]=4 249 B5R0.3 CCC(N)CN Z1263714131 [2,0,0,0,0,0|1,0,1]=4 250 B5R0.3 CCC(O)CN Z419084746 [2,0,0,0,0,0|0,0,2]=4 251 B5R0.3 CNC(=O)CCl Z56891219 [2,0,0,0,0,0|2,0,0]=4 252 B5R0.3 CNC(=O)CN Z57981102 [2,0,0,0,0,0|1,0,0]=3 253 B5R0.3 CNC(=O)CO Z431952700 [2,0,0,0,0,0|2,0,0]=4 254 B5R0.3 CNC(=O)CS Z1203730878 [2,0,0,0,0,0|2,0,0]=4 255 B5R0.3 COC(=O)CN Z57042020 [2,0,0,0,0,0|0,0,0]=2 256 B5R0.3 COC(C)CN Z1795817756 [2,0,0,0,0,0|1,0,1]=4 257 B5R0.3 N=C(CN)NO Z223781376 [2,0,0,0,0,0|2,0,0]=4 258 B5R0.3 NCC(=O)CN Z1198147360 [2,0,0,0,0,0|1,0,0]=3 259 B5R0.3 O=C(CO)CO Z1255442144 [2,0,0,0,0,0|1,0,0]=3 260 B7R0.2 CC(C)NC(=O)CN Z316170536 [1,1,0,0,0,0|1,0,0]=3 261 B7R0.2 CC(C)NC(=O)CO Z431952044 [1,1,0,0,0,0|2,0,0]=4 262 B7R0.2 CC(C)OC(=O)CN Z1245635749 [1,1,0,0,0,0|0,0,0]=2 263 B7R0.2 CC(O)CC(C)CN Z1245536559 [1,1,0,0,0,0|1,0,1]=4 264 B7R0.5 C=C(C)C(=O)OCC Z852747724 [1,1,0,0,0,0|1,0,1]=4 265 B7R0.5 CCNC(=O)C(C)Cl Z147651950 [1,1,0,0,0,0|2,0,0]=4 266 B7R0.5 CCNC(=O)C(C)N Z89265773 [1,1,0,0,0,0|1,0,0]=3 267 B7R0.5 CCOC(=N)C(C)C Z1623864182 [1,1,0,0,0,0|2,0,0]=4 268 B7R0.5 CCOC(=O)C(=O)C Z104472090 [1,1,0,0,0,0|1,0,1]=4 269 B7R0.5 CCOC(=O)C(=O)N Z104475764 [1,1,0,0,0,0|0,0,1]=3 270 B7R0.5 CCOC(=O)C(F)F Z361436550 [1,1,0,0,0,0|1,0,0]=3 271 B7R0.5 CN(C)C(=O)CCO Z635883438 [1,1,0,0,0,0|2,0,0]=4 272 B7R0.7 C/C=C/C(=O)OCC Z2327209524 [1,1,0,0,0,0|1,0,1]=4 273 B7R0.7 C=C=CC(=O)OCC Z1255488905 [1,1,0,0,0,0|1,0,1]=4 274 B7R0.7 CCNC(=O)CCCl Z239813542 [1,1,0,0,0,0|2,0,0]=4 275 B7R0.7 CCNC(=O)CCN Z1449756826 [1,1,0,0,0,0|1,0,0]=3 276 B7R0.7 CCNC(=O)CCO Z975909368 [1,1,0,0,0,0|1,0,0]=3 277 B7R0.7 CCNC(=O)CNC Z594038090 [1,1,0,0,0,0|1,0,0]=3 278 B7R0.7 CCOC(=N)CSC Z4498865780 [1,1,0,0,0,0|2,0,0]=4 279 B7R0.7 CCOC(=O)CC#N Z104473162 [1,1,0,0,0,0|0,0,1]=3 280 B7R0.7 CCOC(=O)CNC Z1262237263 [1,1,0,0,0,0|0,0,0]=2 281 B7R0.7 CCOC(=O)OCC Z104482516 [1,1,0,0,0,0|1,0,0]=3 282 B7R0.10 CCC(=O)C(=O)CC Z104472286 [1,1,0,0,0,0|2,0,0]=4 283 B7R0.10 CCC(C)C(=O)CN Z4526173679 [1,1,0,0,0,0|1,0,0]=3 284 B7R0.10 CCN(C)C(=O)CN Z409025350 [1,1,0,0,0,0|1,0,0]=3 285 B7R0.10 CNC(=O)C(N)CO Z1203584884 [1,1,0,0,0,0|2,0,0]=4 286 B7R0.10 COC(=O)C(N)CO Z104479480 [1,1,0,0,0,0|2,0,0]=4 287 B7R0.11 CC(C)(CN)CCO Z1203583786 [1,1,0,0,0,0|1,0,1]=4 288 B7R0.4 C#CCCNC(=O)C Z1188389866 [1,1,0,0,0,0|2,0,0]=4 289 B7R0.4 C#CCCNC(=O)N Z1188370499 [1,1,0,0,0,0|2,0,0]=4 290 B7R0.4 C#CCCOC(=O)N Z1509495134 [1,1,0,0,0,0|1,0,0]=3 291 B7R0.4 CC(=O)NCCCN Z295405102 [1,1,0,0,0,0|2,0,0]=4 292 B7R0.4 CC(=O)NCCCO Z353570744 [1,1,0,0,0,0|1,0,0]=3 293 B7R0.4 CC(C)OCCCO Z1080358780 [1,1,0,0,0,0|1,0,1]=4 294 B7R0.4 CCCCOC(=O)N Z104476286 [1,1,0,0,0,0|1,0,0]=3 295 B7R0.4 CCCNCC(=O)N Z2211231296 [1,1,0,0,0,0|2,0,0]=4 296 B7R0.4 CCCOCC(=O)O Z406677750 [1,1,0,0,0,0|2,0,0]=4 297 B7R0.4 CCCSCC(=O)C Z447929234 [1,1,0,0,0,0|1,1,0]=4 298 B7R0.4 CCNCCC(=O)N Z2681234913 [1,1,0,0,0,0|2,0,0]=4 299 B7R0.4 CNCCNC(=O)C Z1456777974 [1,1,0,0,0,0|2,0,0]=4 300 B7R0.4 COCCCC(=N)N Z1267882086 [1,1,0,0,0,0|2,0,0]=4 301 B7R0.4 COCCCC(=O)C Z406376722 [1,1,0,0,0,0|1,0,0]=3 302 B7R0.4 COCCCC(=O)O Z316258912 [1,1,0,0,0,0|2,0,0]=4 303 B7R0.4 COCCNC(=O)N Z56904572 [1,1,0,0,0,0|1,0,0]=3 304 B7R0.4 NC(=O)COCCO Z1198148880 [1,1,0,0,0,0|0,0,0]=2 305 B7R0.4 NC(=O)NCCCO Z198194722 [1,1,0,0,0,0|1,0,0]=3 306 B7R0.4 NCCCCC(=O)N Z1639630947 [1,1,0,0,0,0|2,0,0]=4 307 B7R0.4 NCCCOC(=O)N Z3337481796 [1,1,0,0,0,0|1,0,0]=3 308 B7R0.4 NCCOCC(=O)N Z1428158847 [1,1,0,0,0,0|1,0,0]=3 309 B7R0.4 NCCOCC(=O)O Z1650039500 [1,1,0,0,0,0|2,0,0]=4 310 B7R0.4 O=C(O)CNCCO Z425411352 [1,1,0,0,0,0|2,0,0]=4 311 B7R0.4 O=C([O-])CCCCO Z2335631573 [1,1,0,0,0,0|2,0,0]=4 312 B7R0.4 O=C([O-])COCCO Z1744715804 [1,1,0,0,0,0|1,0,0]=3 313 B7R0.6 CC(=O)CCC(=O)O Z104477318 [1,1,0,0,0,0|1,0,1]=4 314 B7R0.6 CC(=O)NCB(O)O Z1198183387 [1,1,0,0,0,0|2,0,0]=4 315 B7R0.6 CC(=O)NCC(=O)O Z85886676 [1,1,0,0,0,0|1,0,1]=4 316 B7R0.6 CC(=O)NCC(C)O Z353603952 [1,1,0,0,0,0|1,0,0]=3 317 B7R0.6 CC(=O)OCC(=S)N Z411884132 [1,1,0,0,0,0|0,1,1]=4 318 B7R0.6 CC(C)CNC(=O)N Z56895708 [1,1,0,0,0,0|2,0,0]=4 319 B7R0.6 CC(O)CCC(=O)O Z838959470 [1,1,0,0,0,0|2,0,0]=4 320 B7R0.6 NC(=O)NCC(=O)O Z57009586 [1,1,0,0,0,0|1,0,1]=4 321 B7R0.8 CS(=O)(=O)CCCO Z1080376164 [1,1,0,0,0,0|2,0,0]=4 322 B7R0.8 CS(=O)(=O)NCCO Z57801016 [1,1,0,0,0,0|2,0,0]=4 323 B7R0.8 NS(=O)(=O)CCCO Z1267897754 [1,1,0,0,0,0|2,0,0]=4 324 B7R0.1 CCCCOCCN Z409191398 [1,1,0,0,0,0|1,0,1]=4 325 B7R0.1 CCCOCCCO Z1080358966 [1,1,0,0,0,0|1,0,1]=4 326 B7R0.1 COCCCCCN Z608347192 [1,1,0,0,0,0|1,0,1]=4 327 B7R0.1 COCCNCCN Z2940670642 [1,1,0,0,0,0|1,0,1]=4 328 B7R0.1 COCCOCCN Z285178622 [1,1,0,0,0,0|0,0,1]=3 329 B7R0.1 COCCOCCO Z849748688 [1,1,0,0,0,0|1,0,1]=4 330 B7R0.1 NCCOCCCO Z2044949087 [1,1,0,0,0,0|0,0,1]=3 331 B7R0.1 NCCSCCCO Z406685362 [1,1,0,0,0,0|0,1,1]=4 332 B7R0.1 OCCCOCCO Z1373668758 [1,1,0,0,0,0|1,0,1]=4 333 B9R0.4 CC(=O)CC(=O)OCCO Z1255385954 [0,2,0,0,0,0|1,0,0]=3 334 B9R0.4 NC(=O)NC(=O)OCCCl Z826530154 [0,2,0,0,0,0|1,0,1]=4 335 B9R0.5 CCNC(=O)NCCCO Z425745002 [0,2,0,0,0,0|2,0,0]=4 336 B9R0.5 CCOC(=O)COCCN Z2235644494 [0,2,0,0,0,0|2,0,0]=4 337 B9R0.5 CNCC(=O)NCCOC Z46191422 [0,2,0,0,0,0|1,0,0]=3 338 B9R0.5 COCCNC(=O)CC#N Z56812707 [0,2,0,0,0,0|1,0,1]=4 339 B9R0.5 COCCNC(=O)CCN Z241054100 [0,2,0,0,0,0|1,0,0]=3 340 B9R0.5 COCCOC(=O)CC#N Z104479724 [0,2,0,0,0,0|0,0,1]=3 341 B9R0.8 CCN(C)C(=O)OCCN Z3899878398 [0,2,0,0,0,0|2,0,0]=4 342 B9R0.18 O=C(CCCO)NCCO Z1203731574 [0,2,0,0,0,0|2,0,0]=4 343 B9R0.34 CC[C@@H](C)NC(=O)CCN Z2939404203 [0,2,0,0,0,0|2,0,0]=4 344 B9R0.34 COCC(C)NC(=O)CCl Z56855795 [0,2,0,0,0,0|2,0,0]=4 345 B9R0.35 CCOC(=O)N(C)CCO Z371625298 [0,2,0,0,0,0|2,0,0]=4 346 B9R0.48 CC(C)CNC(=O)CCN Z1449763104 [0,2,0,0,0,0|2,0,0]=4 347 B9R0.48 NCCC(=O)NCC(=O)O Z1901071297 [0,2,0,0,0,0|1,0,1]=4 348 B9R0.1 CCC(=O)NCCC(=O)O Z85914366 [0,2,0,0,0,0|2,0,0]=4 349 B9R0.1 CN(C)CCOC(=O)CO Z3303138104 [0,2,0,0,0,0|2,0,0]=4 350 B9R0.1 O=C(O)CCNC(=O)CO Z1203746027 [0,2,0,0,0,0|2,0,0]=4 351 B9R0.24 COC(=O)CCC(=O)CN Z3015912776 [0,2,0,0,0,0|1,0,1]=4 352 B9R0.46 COCCCNC(=O)CCl Z56886372 [0,2,0,0,0,0|2,0,0]=4 353 B9R0.47 COCCNC(=O)C(C)Cl Z147652072 [0,2,0,0,0,0|2,0,0]=4 354 B9R0.47 COCCNC(=O)C(C)O Z431951924 [0,2,0,0,0,0|2,0,0]=4 355 B9R0.3 C=CCOC(=O)C(C)(C)N Z3779832271 [0,2,0,0,0,0|1,0,1]=4 356 B9R0.3 CC(C)(C)C(=O)NCCO Z253038802 [0,2,0,0,0,0|2,0,0]=4 357 B9R0.7 CC(C)CNC(=O)C(C)N Z1449763125 [0,2,0,0,0,0|2,0,0]=4 358 B9R0.7 CC(C)COC(=O)C(C)O Z1198162798 [0,2,0,0,0,0|2,0,0]=4 359 B9R0.42 CCC(C)NC(=O)C(C)N Z271752262 [0,2,0,0,0,0|2,0,0]=4 360 B9R0.21 CC(C)(O)CNC(=O)CCl Z1258726508 [0,2,0,0,0,0|2,0,0]=4 361 B9R0.21 NCC(=O)NCC(F)(F)F Z451452570 [0,2,0,0,0,0|2,0,0]=4 362 B7R1.1 NCC1=NCCN1 Z2714784585 [1,0,0,1,0,0|2,0,0]=4 363 B7R1.1 NCC1=NOCC1 Z3217343112 [1,0,0,1,0,0|1,0,0]=3 364 B7R1.1 NCC1COCO1 Z2298138033 [1,0,0,1,0,0|1,0,1]=4 365 B7R1.2 CC1CC(=O)CN1 Z1509349081 [1,0,0,1,0,0|1,0,0]=3 366 B7R1.2 CC1CC(=O)NN1 Z217165562 [1,0,0,1,0,0|2,0,0]=4 367 B7R1.2 CC1CCC(=O)N1 Z1250132456 [1,0,0,1,0,0|2,0,0]=4 368 B7R1.2 CC1CCC(=O)O1 Z963595138 [1,0,0,1,0,0|1,0,0]=3 369 B7R1.2 CC1CNC(=O)O1 Z1198149952 [1,0,0,1,0,0|2,0,0]=4 370 B7R1.2 O=C1CC(CN1)O Z1198157723 [1,0,0,1,0,0|2,0,0]=4 371 B7R1.3 CC1=CCCNC1 Z2143573194 [1,0,0,1,0,0|2,0,0]=4 372 B7R1.3 CC1CNCCO1 Z204013884 [1,0,0,1,0,0|1,0,1]=4 373 B7R1.3 FC1=CCCNC1 Z1570657372 [1,0,0,1,0,0|2,0,0]=4 374 B7R1.3 O=C1C=CCCO1 Z1255402681 [1,0,0,1,0,0|1,0,1]=4 375 B7R1.3 O=C1CCCCC1 Z104474256 [1,0,0,1,0,0|2,0,0]=4 376 B7R1.3 O=C1CCCCN1 Z168817684 [1,0,0,1,0,0|2,0,0]=4 377 B7R1.3 O=C1CCCCO1 Z432085120 [1,0,0,1,0,0|1,0,0]=3 378 B7R1.3 O=C1CCCCS1 Z1726147018 [1,0,0,1,0,0|1,1,0]=4 379 B7R1.3 O=C1CCCNC1 Z3063726909 [1,0,0,1,0,0|1,0,0]=3 380 B7R1.3 O=C1CCCNN1 Z1416174508 [1,0,0,1,0,0|2,0,0]=4 381 B7R1.3 O=C1CCCSC1 Z979714552 [1,0,0,1,0,0|2,0,0]=4 382 B7R1.3 O=C1CCNCC1 Z1741959513 [1,0,0,1,0,0|2,0,0]=4 383 B7R1.3 O=C1CNCCN1 Z56968535 [1,0,0,1,0,0|1,0,0]=3 384 B7R1.3 O=C1CSCCN1 Z337709368 [1,0,0,1,0,0|2,0,0]=4 385 B7R1.3 O=C1NCCCO1 Z1198312172 [1,0,0,1,0,0|2,0,0]=4 386 B7R1.3 O=C1NNCCO1 Z2732442016 [1,0,0,1,0,0|1,0,0]=3 387 B7R1.3 OC1CCONC1 Z3325124334 [1,0,0,1,0,0|0,0,2]=4 388 B7R1.3 OC1CNCCO1 Z1428160315 [1,0,0,1,0,0|0,0,2]=4 389 B7R1.4 C=C1CCOC1=O Z1255438435 [1,0,0,1,0,0|1,0,1]=4 390 B7R1.4 CC1CCCC1=O Z813018382 [1,0,0,1,0,0|2,0,0]=4 391 B7R1.4 CC1CCNC1=O Z1198147219 [1,0,0,1,0,0|2,0,0]=4 392 B7R1.4 CC1NCCC1=O Z2733314209 [1,0,0,1,0,0|2,0,0]=4 393 B7R1.4 C[C@H]1OCC[C@H]1N Z2186882122 [1,0,0,1,0,0|1,0,1]=4 394 B7R1.4 NC1CCOC1=O Z56921763 [1,0,0,1,0,0|0,0,0]=2 395 B7R1.4 NC1CCSC1=O Z56922158 [1,0,0,1,0,0|0,1,0]=3 396 B7R1.4 NC1CONC1=O Z336087816 [1,0,0,1,0,0|2,0,0]=4 397 B7R1.4 NN1CCOC1=O Z1198147716 [1,0,0,1,0,0|1,0,0]=3 398 B7R1.4 N[C@@H]1CCSC1=O Z5069355115 [1,0,0,1,0,0|0,1,0]=3 399 B7R1.4 N[C@@H]1CONC1=O Z1198154206 [1,0,0,1,0,0|2,0,0]=4 400 B7R1.4 N[C@H]1CCSC1=O Z5069354967 [1,0,0,1,0,0|0,1,0]=3 401 B7R1.4 N[C@H]1CONC1=O Z1201618622 [1,0,0,1,0,0|2,0,0]=4 402 B7R1.4 O=C1CCCC1Cl Z104492966 [1,0,0,1,0,0|2,0,0]=4 403 B7R1.4 O=C1NCCC1F Z1203745843 [1,0,0,1,0,0|2,0,0]=4 404 B7R1.10 NC[C@H]1C[C@@H](C1)O Z2755724217 [1,0,0,1,0,0|1,0,1]=4 405 B7R1.22 NNC(=O)C1CC1 Z56891400 [1,0,0,1,0,0|2,0,0]=4 406 B7R1.22 O=C(CCl)C1CC1 Z1205657701 [1,0,0,1,0,0|2,0,0]=4 407 B7R1.22 O=C(CO)C1CC1 Z1172087188 [1,0,0,1,0,0|2,0,0]=4 408 B7R1.12 CC(=O)C1CC1C Z1259336498 [1,0,0,1,0,0|2,0,0]=4 409 B7R1.12 CC1CC1C(=O)N Z33546780 [1,0,0,1,0,0|2,0,0]=4 410 B7R1.18 NC(=O)C1CCC1 Z33546656 [1,0,0,1,0,0|2,0,0]=4 411 B7R1.20 CC(=O)CC1CC1 Z1198160502 [1,0,0,1,0,0|2,0,0]=4 412 B7R1.20 NC(=O)CC1CC1 Z365255854 [1,0,0,1,0,0|2,0,0]=4 413 B7R1.20 NC(=O)NC1CC1 Z57000532 [1,0,0,1,0,0|2,0,0]=4 414 B7R1.23 CC1(OC1CO)C Z1486035926 [1,0,0,1,0,0|1,0,1]=4 415 B7R1.23 CC1(O[C@@H]1CO)C Z1896550092 [1,0,0,1,0,0|1,0,1]=4 416 B7R1.23 CC1(O[C@H]1CO)C Z1896541488 [1,0,0,1,0,0|1,0,1]=4 417 B7R1.24 C1CCNOCC1 Z1824482753 [1,0,0,1,0,0|1,0,1]=4 418 B7R1.24 C1CNCCOC1 Z359510198 [1,0,0,1,0,0|1,0,1]=4 419 B9R1.2 CC1CNCC(O1)CO Z1509113623 [0,1,0,1,0,0|1,0,1]=4 420 B9R1.2 CC1COCC(O1)CN Z4877532429 [0,1,0,1,0,0|1,0,1]=4 421 B9R1.2 NC[C@@H]1C[C@@H](CCO1)O Z3200658572 [0,1,0,1,0,0|1,0,1]=4 422 B9R1.2 O=C1CC(CCN1)CO Z1255502253 [0,1,0,1,0,0|2,0,0]=4 423 B9R1.2 O=C1CCCC(N1)CO Z1198313433 [0,1,0,1,0,0|2,0,0]=4 424 B9R1.2 O=C1CNC[C@@H](N1)CO Z1203822229 [0,1,0,1,0,0|1,0,0]=3 425 B9R1.2 O=C1CNC[C@H](N1)CO Z1203822228 [0,1,0,1,0,0|1,0,0]=3 426 B9R1.15 CNC1CCCNC1=O Z1795818556 [0,1,0,1,0,0|2,0,0]=4 427 B9R1.15 NCC1CCCNC1=O Z2289798362 [0,1,0,1,0,0|2,0,0]=4 428 B9R1.15 O=C1NCCOC1CO Z2239006921 [0,1,0,1,0,0|2,0,0]=4 429 B9R1.33 O=C1CCCN1CCO Z104478410 [0,1,0,1,0,0|2,0,0]=4 430 B9R1.33 O=C1NCCC1CCO Z1203745921 [0,1,0,1,0,0|2,0,0]=4 431 B9R1.33 O=C1NCCN1CCO Z111875094 [0,1,0,1,0,0|2,0,0]=4 432 B9R1.33 O=C1OCCN1CCO Z425795034 [0,1,0,1,0,0|2,0,0]=4 433 B9R1.48 CC1COCCC(=O)N1 Z1203833663 [0,1,0,1,0,0|2,0,0]=4 434 B9R1.48 CN1CCCNC(=O)C1 Z1031052044 [0,1,0,1,0,0|2,0,0]=4 435 B9R1.49 O=C1CCCC(=O)NC1 Z1255404954 [0,1,0,1,0,0|1,0,1]=4 436 B9R1.49 O=C1CCCC(CN1)O Z1255401193 [0,1,0,1,0,0|2,0,0]=4 437 B9R1.50 O=C1CCCCNCC1 Z5186715583 [0,1,0,1,0,0|2,0,0]=4 438 B9R1.50 O=C1CCNCCCN1 Z1262578602 [0,1,0,1,0,0|2,0,0]=4 439 B9R1.69 CC1NC(=O)COC1=O Z1203734682 [0,1,0,1,0,0|0,0,2]=4 440 B9R1.69 CN1CC(CCC1=O)O Z1504678538 [0,1,0,1,0,0|2,0,0]=4 441 B9R1.75 CCOC(=O)CC1CO1 Z1255420015 [0,1,0,1,0,0|2,0,0]=4 442 B9R1.75 CCOC(=O)C[C@@H]1CO1 Z1198160302 [0,1,0,1,0,0|2,0,0]=4 443 B9R1.75 CCOC(=O)C[C@H]1CO1 Z1255395520 [0,1,0,1,0,0|2,0,0]=4 444 B9R1.100 NCCOC(=O)C1CC1 Z1992316419 [0,1,0,1,0,0|2,0,0]=4 445 B9R1.3 CC1CCNC(=O)C1N Z1203587127 [0,1,0,1,0,0|2,0,0]=4 446 B9R1.3 CN1CCCC(C1=O)N Z1203581592 [0,1,0,1,0,0|2,0,0]=4 447 B9R1.3 NC1CCCN(C1=O)O Z1203581684 [0,1,0,1,0,0|2,0,0]=4 448 B9R1.5 CC1NCCCNC1=O Z1203829873 [0,1,0,1,0,0|2,0,0]=4 449 B9R1.5 CN1CCCNCC1=O Z1198179782 [0,1,0,1,0,0|2,0,0]=4 450 B9R1.5 NC1CCCCCC1=O Z2213893401 [0,1,0,1,0,0|2,0,0]=4 451 B9R1.5 NC1CCCCNC1=O Z281895050 [0,1,0,1,0,0|2,0,0]=4 452 B9R1.11 CCC(=O)C1CCOC1 Z1138843357 [0,1,0,1,0,0|2,0,0]=4 453 B9R1.11 NCC(=O)N1CCCC1 Z1449745390 [0,1,0,1,0,0|2,0,0]=4 454 B9R1.11 O=C(CCl)C1CCCO1 Z1205660980 [0,1,0,1,0,0|2,0,0]=4 455 B9R1.132 CN1C(=O)CCC1CO Z1255502015 [0,1,0,1,0,0|2,0,0]=4 456 B9R1.132 N[C@H]1C(=O)OC[C@H]1CO Z4342606943 [0,1,0,1,0,0|0,0,0]=2 457 B9R1.1 CC1COC(CO1)CN Z4984374432 [0,1,0,1,0,0|1,0,1]=4 458 B9R1.1 C[C@@H]1CO[C@H](CO1)CN Z4918953814 [0,1,0,1,0,0|1,0,1]=4 459 B9R1.17 COCCOC1CNC1 Z1318513962 [0,1,0,1,0,0|1,0,1]=4 460 B9R1.79 NCC(=O)NC1CCC1 Z1450045072 [0,1,0,1,0,0|2,0,0]=4 461 B9R1.79 O=C(CO)OC1CCC1 Z1962692460 [0,1,0,1,0,0|2,0,0]=4 462 B9R1.80 NCC(=O)NCC1CC1 Z1449922932 [0,1,0,1,0,0|2,0,0]=4 463 B9R1.80 NCC(=O)OCC1CC1 Z1262327490 [0,1,0,1,0,0|1,0,0]=3 464 B9R1.80 O=C(CCl)COC1CC1 Z2831879239 [0,1,0,1,0,0|2,0,0]=4 465 B9R1.89 NCC1COCCOC1 Z2310678775 [0,1,0,1,0,0|1,0,1]=4 466 B9R1.6 CC(N)C1COCCO1 Z3482741168 [0,1,0,1,0,0|1,0,1]=4 467 B9R1.23 CN1CC(OC1=O)CO Z1509012500 [0,1,0,1,0,0|2,0,0]=4 468 B9R1.35 O=C1CCC(O1)C(=O)O Z1198149867 [0,1,0,1,0,0|1,0,1]=4 469 B9R1.35 O=C1CN[C@@H](C1)C(=O)O Z2902023119 [0,1,0,1,0,0|1,0,1]=4 470 B9R1.40 CC1(NCCOC1=O)C Z406682076 [0,1,0,1,0,0|2,0,0]=4 471 B9R1.106 CC1(C(=O)NCC1O)C Z1889709990 [0,1,0,1,0,0|2,0,0]=4 472 B9R1.112 CC(N)C(=O)NC1CC1 Z1449762329 [0,1,0,1,0,0|2,0,0]=4 473 B9R1.10 CC1(CCC(=O)CC1)O Z1255440285 [0,1,0,1,0,0|2,0,0]=4 474 B9R1.125 CC1(CCC(=O)N1)CO Z1258978054 [0,1,0,1,0,0|2,0,0]=4 475 B9R1.138 CC1(CNC(=O)C1N)C Z1203653557 [0,1,0,1,0,0|2,0,0]=4 476 B9R1.138 CC1(COC(=O)C1N)C Z2092370679 [0,1,0,1,0,0|1,0,0]=3 477 B9R1.138 CC1(COC(=O)[C@@H]1O)C Z1065885480 [0,1,0,1,0,0|2,0,0]=4