0 B8R1.1 C#CC1CCC(C1)N Z3215421078 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.1 C#C[C@H]1CC[C@H](C1)N Z4607393601 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.1 CC1CCC(C1)C=O Z1268606446 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.1 CCN1CCC(C1)N Z415647776 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.1 CO[C@@H]1CC[C@H](C1)N Z3282728045 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.1 CSC1CCC(C1)N Z1245790495 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.1 N#CC1CCC(C1)O Z1258995690 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.1 N#C[C@H]1CC[C@H](C1)N Z2375429659 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.1 NCC1CCC(C1)F Z3074473433 [0,0,0,0,0,0|4,0,0]=4 9 B7R1.1 CNC1CCCC1 Z102766802 [1,0,0,0,0,0|2,0,1]=4 10 B7R1.1 N#CC1CCCC1 Z285131394 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.1 NCC1CCCC1 Z367452206 [1,0,0,0,0,0|3,0,0]=4 12 B7R1.1 NNC1CCCC1 Z285139110 [1,0,0,0,0,0|2,0,1]=4 13 B7R1.1 O=CC1=CCCC1 Z1190318866 [1,0,0,0,0,0|2,0,1]=4 14 B7R1.1 O=CC1CCCC1 Z875036058 [1,0,0,0,0,0|2,0,0]=3 15 B7R1.1 O=CC1CCOC1 Z199056102 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.1 O=CC1CCSC1 Z1201681645 [1,0,0,0,0,0|3,0,0]=4 17 B7R1.1 O=CN1CCCC1 Z1255394997 [1,0,0,0,0,0|1,0,0]=2 18 B7R1.1 O=NN1CCOC1 Z1198157988 [1,0,0,0,0,0|1,0,0]=2 19 B7R1.1 OCC1CCCC1 Z397587414 [1,0,0,0,0,0|2,0,1]=4 20 B7R1.2 CC1CC(=O)CN1 Z1509349081 [1,0,0,0,0,0|3,0,0]=4 21 B7R1.2 CC1CC(CN1)O Z1201051000 [1,0,0,0,0,0|3,0,0]=4 22 B7R1.2 CC1CCC(=O)N1 Z1250132456 [1,0,0,0,0,0|3,0,0]=4 23 B7R1.2 CC1CCC(=O)O1 Z963595138 [1,0,0,0,0,0|3,0,0]=4 24 B7R1.2 CC1CCC(C1)O Z1233224917 [1,0,0,0,0,0|2,0,0]=3 25 B7R1.2 CC1CNC(=N)C1 Z4085233400 [1,0,0,0,0,0|3,0,0]=4 26 B7R1.2 CC1CNC(=O)C1 Z959319678 [1,0,0,0,0,0|3,0,0]=4 27 B7R1.2 CN1CCC(=O)C1 Z415646350 [1,0,0,0,0,0|1,0,2]=4 28 B7R1.2 NC1CCS(=O)C1 Z1267860904 [1,0,0,0,0,0|2,0,0]=3 29 B7R1.2 NC1CNC(=O)C1 Z1198329759 [1,0,0,0,0,0|3,0,0]=4 30 B7R1.2 N[C@H]1CC[C@H](C1)N Z2752749810 [1,0,0,0,0,0|2,0,1]=4 31 B7R1.2 O=C1CC(CN1)O Z1198157723 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.7 CC1CCN(C1)CCO Z785808944 [0,1,0,0,0,0|2,0,1]=4 33 B9R1.21 CCN1CCC(C1)CN Z234895457 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.21 CCN1CCC(C1)NC Z415647768 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.21 N#CN1CCC(C1)CN Z4922944797 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.23 CCN1CC(C(C1)N)C Z1268671316 [0,1,0,0,0,0|3,0,0]=4 37 B9R1.35 CC(=O)N1CCC(C1)I Z1486011417 [0,1,0,0,0,0|2,0,0]=3 38 B9R1.35 CC(=O)N1CCC(C1)N Z1421529530 [0,1,0,0,0,0|2,0,0]=3 39 B9R1.35 CC(=O)N1CCC(C1)O Z1037571952 [0,1,0,0,0,0|1,0,0]=2 40 B9R1.35 CC(=O)N1CC[C@H](C1)N Z4485354356 [0,1,0,0,0,0|2,0,0]=3 41 B9R1.35 CC1CCC(C1)C(=O)O Z1190318311 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.35 NC(=O)C1CC(CN1)O Z56960275 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.35 NC(=O)N1CCC(C1)N Z1342879018 [0,1,0,0,0,0|2,0,0]=3 44 B9R1.35 NC(=O)[C@H]1CC[C@H](C1)N Z2238896801 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.35 N[C@@H]1CC[C@@H](C1)C(=O)O Z2307368779 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.35 O=C(O)C1CCC(C1)F Z1981870592 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O Z2470415380 [0,1,0,0,0,0|3,0,0]=4 48 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O Z802856442 [0,1,0,0,0,0|3,0,0]=4 49 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O Z1201624589 [0,1,0,0,0,0|3,0,0]=4 50 B9R1.133 CC1(CCC(C1)C=O)C Z1416223919 [0,1,0,0,0,0|3,0,0]=4 51 B9R1.133 O=CC1CCC(C1)(F)F Z1989480634 [0,1,0,0,0,0|3,0,0]=4 52 B7R0.2 CC(O)CC(C)CN Z1245536559 [0,0,1,0,0,0|3,0,0]=4 53 B7R0.2 CN(CC(=O)O)N=O Z1198151307 [0,0,1,0,0,0|1,0,1]=3 54 B7R0.3 CC(CN)CCCO Z2234185702 [0,0,1,0,0,0|3,0,0]=4 55 B7R0.3 CCC(O)CCCN Z1259162031 [0,0,1,0,0,0|3,0,0]=4 56 B7R0.3 CCCCN(C)N=O Z1198149449 [0,0,1,0,0,0|1,0,0]=2 57 B7R0.3 CCNCC(C)CC Z335456758 [0,0,1,0,0,0|3,0,0]=4 58 B7R0.3 CCNCC(O)CC Z600449680 [0,0,1,0,0,0|2,0,0]=3 59 B7R0.3 CN(C=O)CCC#N Z1258520788 [0,0,1,0,0,0|2,0,1]=4 60 B7R0.4 COCCCC(C)O Z854048762 [0,0,1,0,0,0|3,0,0]=4 61 B7R0.12 CCC(CC)CCO Z1198174469 [0,0,1,0,0,0|3,0,0]=4 62 B7R0.12 CCN(CC)CCN Z104472254 [0,0,1,0,0,0|3,0,0]=4 63 B9R2.39 NC1CN2CCC1C2 Z3490555917 [0,0,0,1,0,0|3,0,0]=4 64 B9R2.39 O=C1NC2CCC1C2 Z1238833321 [0,0,0,1,0,0|3,0,0]=4 65 B9R2.39 OC1CC2CCC1C2 Z104479470 [0,0,0,1,0,0|3,0,0]=4 66 B9R2.39 OC1CN2CCC1C2 Z1270446274 [0,0,0,1,0,0|2,0,0]=3 67 B9R2.39 O[C@@H]1C[C@H]2CN[C@@H]1C2 Z3288510014 [0,0,0,1,0,0|3,0,0]=4 68 B9R2.47 N#C[C@@H]1C[C@@H]2O[C@@H]2C1 Z3681332314 [0,0,0,1,0,0|3,0,0]=4 69 B9R2.47 O=CC1CC2CC2C1 Z1407035097 [0,0,0,1,0,0|3,0,0]=4 70 B9R2.59 O=CC1CC2CC1C2 Z4318223838 [0,0,0,1,0,0|3,0,0]=4 71 B9R2.61 O=CC12CCC(C1)C2 Z3626807045 [0,0,0,1,0,0|3,0,0]=4 72 B9R2.68 C1CN2CCC(C2)N1 Z2234631228 [0,0,0,1,0,0|3,0,0]=4 73 B9R2.110 NC12CCN(C1)CC2 Z2724010463 [0,0,0,1,0,0|3,0,0]=4 74 B9R2.110 OC12CCN(C1)CC2 Z4459532026 [0,0,0,1,0,0|2,0,0]=3 75 B7R1.8 CN[C@@H]1CC[C@H]1O Z2678247023 [0,0,0,0,1,0|2,0,1]=4 76 B7R1.10 CNC1CC(C1)O Z1318186466 [0,0,0,0,1,0|2,0,1]=4 77 B7R1.10 NC[C@H]1C[C@@H](C1)O Z2755724217 [0,0,0,0,1,0|3,0,0]=4 78 B9R1.1 CC1CCC(=NO)CC1 Z49568435 [0,0,0,0,0,1|2,0,1]=4 79 B9R1.1 CC1CCC(CC1)C=O Z1250055138 [0,0,0,0,0,1|3,0,0]=4 80 B9R1.1 CCN1CCC(CC1)N Z96092729 [0,0,0,0,0,1|3,0,0]=4 81 B9R1.1 CCN1CCC(CC1)O Z197264618 [0,0,0,0,0,1|2,0,0]=3 82 B9R1.1 CN1CCN(CC1)N=O Z1198157883 [0,0,0,0,0,1|2,0,0]=3 83 B9R1.1 CNC1CCC(CC1)O Z138503904 [0,0,0,0,0,1|2,0,1]=4 84 B9R1.1 CN[C@H]1CC[C@H](CC1)O Z3241259883 [0,0,0,0,0,1|2,0,1]=4 85 B9R1.1 COC1CCC(CC1)O Z904962746 [0,0,0,0,0,1|3,0,0]=4 86 B9R1.1 C[C@H]1CC[C@@H](CC1)C=O Z1511765971 [0,0,0,0,0,1|3,0,0]=4 87 B9R1.1 N#CN1CCC(CC1)O Z1255400579 [0,0,0,0,0,1|2,0,0]=3 88 B9R1.1 O=CC1CCC(CC1)F Z1813155376 [0,0,0,0,0,1|3,0,0]=4 89 B9R1.1 OCC1CCC(CC1)O Z1255451065 [0,0,0,0,0,1|2,0,1]=4 90 B9R1.2 CC1CC(CCO1)C=O Z1268606322 [0,0,0,0,0,1|3,0,0]=4 91 B9R1.2 CC1CCCC(C1)C=O Z1217182161 [0,0,0,0,0,1|3,0,0]=4 92 B9R1.2 CCC1CCCC(C1)O Z1192057272 [0,0,0,0,0,1|3,0,0]=4 93 B9R1.2 CCN1CCCC(C1)N Z736883394 [0,0,0,0,0,1|3,0,0]=4 94 B9R1.2 CCN1CCCC(C1)O Z104478102 [0,0,0,0,0,1|2,0,0]=3 95 B9R1.2 CNC1CCCC(C1)O Z3064472236 [0,0,0,0,0,1|2,0,1]=4 96 B9R1.2 COC1CCCC(C1)O Z104476334 [0,0,0,0,0,1|3,0,0]=4 97 B9R1.2 NC[C@@H]1C[C@@H](CCO1)O Z3200658572 [0,0,0,0,0,1|3,0,0]=4 98 B9R1.2 O=CC1CCCC(C1)F Z1813182338 [0,0,0,0,0,1|3,0,0]=4 99 B9R1.2 O=NN1CCNC(=O)C1 Z1203748915 [0,0,0,0,0,1|0,0,2]=3 100 B6R0.1 C=CCC(O)CC Z808662120 [1,0,1,0,0,0|2,0,0]=4 101 B6R0.1 CCC(C)CNC Z1266854907 [1,0,1,0,0,0|2,0,0]=4 102 B6R0.1 CCC(N)CCO Z1258578227 [1,0,1,0,0,0|1,0,1]=4 103 B6R0.1 CCC(O)CCN Z406342052 [1,0,1,0,0,0|1,0,1]=4 104 B6R0.1 CCC(O)CCO Z1198157972 [1,0,1,0,0,0|1,0,1]=4 105 B6R0.1 CCCN(C)N=O Z1198147496 [1,0,1,0,0,0|0,0,0]=2 106 B6R0.1 CCS(=O)CCN Z1266854910 [1,0,1,0,0,0|2,0,0]=4 107 B6R0.1 CNC(=O)CCO Z975909370 [1,0,1,0,0,0|2,0,0]=4 108 B6R0.1 CNC[C@H](O)CO Z600533638 [1,0,1,0,0,0|2,0,0]=4 109 B6R0.2 CC(=O)CC(C)N Z57329385 [1,0,1,0,0,0|2,0,0]=4 110 B6R0.2 CC(N)CS(=O)C Z1238793449 [1,0,1,0,0,0|2,0,0]=4 111 B6R0.4 C#CCCC(C)O Z854048672 [1,0,1,0,0,0|2,0,0]=4 112 B6R0.4 CC(N)CCCO Z1203578676 [1,0,1,0,0,0|1,0,1]=4 113 B6R0.4 CC(O)CCCN Z1198178891 [1,0,1,0,0,0|1,0,1]=4 114 B6R0.4 CCNCC(C)O Z138692768 [1,0,1,0,0,0|2,0,0]=4 115 B6R0.4 CNCCC(C)C Z607822512 [1,0,1,0,0,0|2,0,0]=4 116 B6R0.4 CNCCC(C)O Z1203731868 [1,0,1,0,0,0|1,0,0]=3 117 B6R0.4 COCCC(C)O Z818738042 [1,0,1,0,0,0|2,0,0]=4 118 B6R0.4 NC(=O)CCCO Z1203578394 [1,0,1,0,0,0|2,0,0]=4 119 B6R0.6 CCNCCCO Z138139914 [1,0,1,0,0,0|2,0,0]=4 120 B6R0.9 CCN(CC)CC Z137796018 [1,0,1,0,0,0|2,0,0]=4 121 B6R0.9 CCN(CC)N=O Z1255485632 [1,0,1,0,0,0|0,0,0]=2 122 B6R1.2 C=C1CCNC1 Z3019986853 [2,0,0,0,0,0|1,0,1]=4 123 B6R1.2 CC1CCNC1 Z729771722 [2,0,0,0,0,0|1,0,0]=3 124 B6R1.2 CC1CNNC1 Z4953319766 [2,0,0,0,0,0|2,0,0]=4 125 B6R1.2 FC1CCNC1 Z1139751347 [2,0,0,0,0,0|1,0,0]=3 126 B6R1.2 N=C1CCCN1 Z204007506 [2,0,0,0,0,0|2,0,0]=4 127 B6R1.2 NC1CCOC1 Z802544198 [2,0,0,0,0,0|2,0,0]=4 128 B6R1.2 NC1CCSC1 Z1267885911 [2,0,0,0,0,0|2,0,0]=4 129 B6R1.2 O=C1CCCN1 Z104472846 [2,0,0,0,0,0|2,0,0]=4 130 B6R1.2 O=C1CCNC1 Z1741976513 [2,0,0,0,0,0|0,0,2]=4 131 B6R1.2 O=C1CCSC1 Z104495638 [2,0,0,0,0,0|2,0,0]=4 132 B6R1.2 O=S1CCCC1 Z278052312 [2,0,0,0,0,0|1,0,0]=3 133 B6R1.2 OC1C=CCC1 Z1255485846 [2,0,0,0,0,0|1,0,1]=4 134 B6R1.2 OC1CCOC1 Z1124541349 [2,0,0,0,0,0|1,0,0]=3 135 B6R1.2 OC1CCSC1 Z335244836 [2,0,0,0,0,0|1,0,0]=3 136 B6R1.2 O[C@@H]1CCNC1 Z1263714129 [2,0,0,0,0,0|0,0,0]=2 137 B6R1.2 O[C@H]1CCNC1 Z1263714116 [2,0,0,0,0,0|0,0,0]=2 138 B8R0.8 CC(=O)N(C)CCCN Z319974634 [0,1,1,0,0,0|2,0,0]=4 139 B8R0.11 CCCCN(CC)N=O Z1198147487 [0,1,1,0,0,0|1,0,0]=3 140 B8R0.11 CCN(CC)CCCO Z1675167178 [0,1,1,0,0,0|2,0,0]=4 141 B8R0.28 CC(C)CCNC(=O)N Z56904577 [0,1,1,0,0,0|2,0,0]=4 142 B8R0.28 CC(O)CCCC(=O)[O-] Z1762997411 [0,1,1,0,0,0|2,0,0]=4 143 B8R1.7 CC(=O)C1CCCC1 Z513735352 [1,1,0,0,0,0|2,0,0]=4 144 B8R1.7 N=C(N)N1CCCC1 Z161313378 [1,1,0,0,0,0|2,0,0]=4 145 B8R1.7 NC(=O)C1CCCC1 Z33546657 [1,1,0,0,0,0|2,0,0]=4 146 B8R1.7 NC(=O)N1CCCC1 Z56907605 [1,1,0,0,0,0|1,0,0]=3 147 B8R1.7 NC(=S)N1CCCC1 Z55928944 [1,1,0,0,0,0|1,1,0]=4 148 B8R1.7 O=C(O)C1CCCC1 Z104476116 [1,1,0,0,0,0|2,0,0]=4 149 B8R1.7 S=C(S)N1CCCC1 Z56946833 [1,1,0,0,0,0|1,1,0]=4 150 B8R1.8 C#CCN1CCCC1 Z1511513967 [1,1,0,0,0,0|2,0,0]=4 151 B8R1.8 CCCN1CCCC1 Z4634999686 [1,1,0,0,0,0|2,0,0]=4 152 B8R1.8 ClCCN1CCCC1 Z104489566 [1,1,0,0,0,0|2,0,0]=4 153 B8R1.8 N#CCN1CCCC1 Z168893456 [1,1,0,0,0,0|2,0,0]=4 154 B8R1.8 NCCN1CCCC1 Z812516900 [1,1,0,0,0,0|2,0,0]=4 155 B8R1.8 O=C=NC1CCCC1 Z316172554 [1,1,0,0,0,0|1,0,0]=3 156 B8R1.8 O=CCC1CCCC1 Z993017732 [1,1,0,0,0,0|2,0,0]=4 157 B8R1.8 OCCN1CCCC1 Z104477730 [1,1,0,0,0,0|1,0,1]=4 158 B8R1.11 CC1CCCC1C=O Z1268606470 [1,1,0,0,0,0|2,0,0]=4 159 B8R1.52 CC1(CCCC1)C=O Z1255466724 [1,1,0,0,0,0|2,0,0]=4 160 B8R1.52 O=CC1(CCCC1)Br Z1511865834 [1,1,0,0,0,0|2,0,0]=4 161 B8R1.18 CN1CC(CC1=O)O Z1201051099 [1,1,0,0,0,0|1,0,1]=4 162 B8R1.18 NC1C[C@@H]([C@@H](C1)O)O Z2830494512 [1,1,0,0,0,0|1,0,1]=4 163 B8R1.18 N[C@@H]1C[C@@H](C[C@H]1O)O Z3576076783 [1,1,0,0,0,0|1,0,1]=4 164 B8R1.18 N[C@H]1C[C@@H]([C@@H](C1)O)O Z1262685736 [1,1,0,0,0,0|1,0,1]=4 165 B8R1.50 N[C@H]1C(=O)NC[C@@H]1O Z5183356392 [1,1,0,0,0,0|2,0,0]=4 166 B8R1.51 CN1CCC(C1)(C)N Z2805881504 [1,1,0,0,0,0|2,0,0]=4 167 B8R1.51 NC1CCS(=O)(=O)C1 Z56998603 [1,1,0,0,0,0|2,0,0]=4 168 B8R1.51 O=S1(=O)CCC(C1)O Z57161902 [1,1,0,0,0,0|1,0,0]=3 169 B8R1.23 CC(=O)N1CC(C1)N Z1154674340 [0,1,0,0,1,0|2,0,0]=4 170 B8R1.23 NC(=O)N1CC(C1)N Z3297611731 [0,1,0,0,1,0|2,0,0]=4 171 B8R1.23 NC(=O)N1CC(C1)O Z1090111906 [0,1,0,0,1,0|1,0,0]=3 172 B8R1.23 O=C([O-])[C@H]1C[C@@H](C1)O Z4399321929 [0,1,0,0,1,0|2,0,0]=4 173 B8R1.47 COC1CC(C1)C=O Z1880960307 [0,1,0,0,1,0|2,0,0]=4 174 B8R1.47 COC1CN(C1)C#N Z2066077778 [0,1,0,0,1,0|2,0,0]=4 175 B10R1.1 C#CCN1CCC(CC1)O Z103891120 [0,1,0,0,0,1|2,0,0]=4 176 B10R1.1 CCCN1CCC(CC1)O Z197264630 [0,1,0,0,0,1|2,0,0]=4 177 B10R1.1 N#CCN1CCC(CC1)O Z125399900 [0,1,0,0,0,1|2,0,0]=4 178 B10R1.1 NCCN1CCC(CC1)O Z3234812755 [0,1,0,0,0,1|2,0,0]=4 179 B10R1.1 OC1CCN(CC1)CCF Z5861811904 [0,1,0,0,0,1|2,0,0]=4 180 B10R1.3 COC1CCC(CC1)C=O Z1511761393 [0,1,0,0,0,1|2,0,0]=4 181 B10R1.3 O=NN1CCN(CC1)N=O Z1198147437 [0,1,0,0,0,1|1,0,1]=4 182 B10R1.13 CC(=O)N1CCC(CC1)N Z90664455 [0,1,0,0,0,1|2,0,0]=4 183 B10R1.13 NC(=O)C1CCC(CC1)O Z935127666 [0,1,0,0,0,1|2,0,0]=4 184 B10R1.13 NC(=O)N1CCC(CC1)N Z217651700 [0,1,0,0,0,1|2,0,0]=4 185 B10R1.13 NC(=O)N1CCC(CC1)O Z198194442 [0,1,0,0,0,1|1,0,0]=3 186 B10R1.13 O=C(O)C1CCC(CC1)O Z336079608 [0,1,0,0,0,1|2,0,0]=4 187 B10R1.13 O=C(O)C1CCC(CN1)O Z1198181269 [0,1,0,0,0,1|2,0,0]=4 188 B10R1.26 O=NN1CCC(CC1)(F)F Z1255384660 [0,1,0,0,0,1|1,0,0]=3 189 B10R1.10 CCCN1CCCC(C1)O Z197276296 [0,1,0,0,0,1|2,0,0]=4 190 B10R1.10 OCCN1CCCC(C1)O Z197276438 [0,1,0,0,0,1|1,0,1]=4 191 B10R1.113 CC(=O)N1CCN[C@@H](C1)C Z1766227743 [0,1,0,0,0,1|2,0,0]=4 192 B10R1.113 CC1CCCN(C1)C(=O)N Z198194364 [0,1,0,0,0,1|2,0,0]=4 193 B10R1.113 O=C(O)C1CCCC(C1)O Z1205494896 [0,1,0,0,0,1|2,0,0]=4 194 B10R1.172 COC1CCCC(C1)C=O Z1509050363 [0,1,0,0,0,1|2,0,0]=4 195 B10R1.14 C=CC(=O)N1CCC(C1)C Z785809022 [0,2,0,0,0,0|2,0,0]=4 196 B10R1.14 CCC(=O)N1CCC(C1)N Z934126228 [0,2,0,0,0,0|2,0,0]=4 197 B10R1.14 COC(=O)N1CCC(C1)N Z1262398482 [0,2,0,0,0,0|2,0,0]=4 198 B10R1.54 C=C(Br)CN1CC[C@H](C1)O Z1206290581 [0,2,0,0,0,0|2,0,0]=4 199 B10R1.54 CC1CCN(C1)CC(=O)O Z1459983829 [0,2,0,0,0,0|2,0,0]=4 200 B10R1.96 CO[C@H]1CCN(C1)CCN Z4855605045 [0,2,0,0,0,0|2,0,0]=4 201 B10R1.31 CC(=O)N1CCC(C1)CN Z2108810043 [0,2,0,0,0,0|2,0,0]=4 202 B10R1.31 CCN1CCC(C1)C(=O)O Z1459883437 [0,2,0,0,0,0|2,0,0]=4 203 B10R1.31 COC1CCC(C1)C(=O)O Z1509041249 [0,2,0,0,0,0|2,0,0]=4 204 B10R1.31 NCC1CCN(C1)C(=O)N Z2065788156 [0,2,0,0,0,0|2,0,0]=4 205 B10R1.59 N[C@@H]1C[C@@H](C[C@@H]1C(=O)O)O Z2939860921 [0,2,0,0,0,0|2,0,0]=4 206 B10R1.58 CC(C)N1C[C@H]([C@@H](C1)O)N Z2306938356 [0,2,0,0,0,0|2,0,0]=4 207 B10R1.58 N[C@@H]1C[C@@H](C[C@H]1O)C(=O)O Z3335066881 [0,2,0,0,0,0|2,0,0]=4 208 B10R1.58 N[C@H]1C[C@H](C[C@H]1O)C(=O)O Z5062872452 [0,2,0,0,0,0|2,0,0]=4 209 B10R1.58 O=C(O)[C@@H]1C[C@@H]([C@@H](C1)O)O Z2704517658 [0,2,0,0,0,0|2,0,0]=4 210 B10R1.55 CS(=O)(=O)C1CCC(C1)O Z1245790139 [0,2,0,0,0,0|2,0,0]=4 211 B10R1.55 NC1CCN(C1)S(=O)(=O)F Z4767953593 [0,2,0,0,0,0|2,0,0]=4 212 B10R1.55 O=S(=O)(F)[C@H]1CC[C@H](C1)O Z4791710817 [0,2,0,0,0,0|2,0,0]=4 213 B10R1.470 N[C@@]1(CC[C@@H](C1)O)C(=O)O Z3069146834 [0,2,0,0,0,0|2,0,0]=4 214 B8R1.4 CN1CC(CCO1)O Z5948414894 [0,0,1,1,0,0|2,0,0]=4 215 B8R1.40 CCN(C)CC1CO1 Z409025020 [0,0,1,1,0,0|2,0,0]=4 216 B8R1.2 CCC1CNCCO1 Z283724556 [0,0,1,1,0,0|2,0,0]=4 217 B8R1.2 O=CC1CCCOC1 Z1065877672 [0,0,1,1,0,0|2,0,0]=4 218 B8R1.2 O=CN1CCCCC1 Z1255415437 [0,0,1,1,0,0|2,0,0]=4 219 B8R1.2 O=NN1CCCCC1 Z1198147906 [0,0,1,1,0,0|1,0,0]=3 220 B8R1.2 O=NN1CCNCC1 Z1198149478 [0,0,1,1,0,0|2,0,0]=4 221 B8R1.2 O=NN1CCOCC1 Z1255360497 [0,0,1,1,0,0|2,0,0]=4 222 B8R1.2 O=NN1CCSCC1 Z1198157610 [0,0,1,1,0,0|2,0,0]=4 223 B8R1.3 CC1CCC(=O)NC1 Z969194082 [0,0,1,1,0,0|2,0,0]=4 224 B8R1.3 CC1CCC(CN1)O Z2350906968 [0,0,1,1,0,0|2,0,0]=4 225 B8R1.3 C[C@@H]1CC[C@@H](CN1)O Z2309899176 [0,0,1,1,0,0|2,0,0]=4 226 B8R1.3 C[C@@H]1CC[C@H](CN1)O Z2327179252 [0,0,1,1,0,0|2,0,0]=4 227 B8R1.3 NC1CCC(=O)NC1 Z992717028 [0,0,1,1,0,0|2,0,0]=4 228 B8R1.3 O=C1NCC(CN1)O Z1198163621 [0,0,1,1,0,0|2,0,0]=4 229 B8R1.5 C[C@@H]1CCNC[C@@H]1O Z2307368538 [0,0,1,1,0,0|2,0,0]=4 230 B8R1.10 O=CCCC1CCO1 Z2327124310 [0,0,1,1,0,0|2,0,0]=4 231 B8R1.19 CC1(CCNC1=O)C Z1201628732 [0,0,1,1,0,0|2,0,0]=4 232 B8R1.19 CC1(CCNC1=O)N Z2718904456 [0,0,1,1,0,0|2,0,0]=4 233 B8R1.72 CC1(CCNCC1)O Z1416200885 [0,0,1,1,0,0|2,0,0]=4 234 B10R2.582 OC12CCN(CC1)CC2 Z4644445224 [0,0,0,1,0,1|2,0,0]=4 235 B10R2.61 O=C1OC2CCNC1C2 Z5219768392 [0,0,0,1,0,1|2,0,0]=4 236 B10R2.99 O=CC1CC2CCC1O2 Z1511807599 [0,0,0,1,0,1|2,0,0]=4 237 B10R2.63 CC1CN2CC(=O)C1C2 Z5336163215 [0,1,0,1,0,0|2,0,0]=4 238 B10R2.308 O=C(O)[C@@]12C[C@H]([C@@H]1C2)O Z3380556323 [0,1,0,1,0,0|2,0,0]=4 239 B10R2.357 CC(=O)N1CC2OC2C1 Z1999525202 [0,1,0,1,0,0|1,0,0]=3 240 B6R0.3 CC(C)N(C)C=O Z1258520821 [0,0,1,0,1,0|2,0,0]=4 241 B6R1.6 O=CC1CCC1 Z1079442452 [1,0,0,0,1,0|2,0,0]=4 242 B6R1.5 CN1CC(C1)N Z1741969265 [1,0,0,0,1,0|2,0,0]=4 243 B6R1.5 N[C@H]1C[C@H](C1)O Z1416282421 [1,0,0,0,1,0|1,0,1]=4 244 B6R1.5 O[C@H]1C[C@H](C1)O Z2065357735 [1,0,0,0,1,0|1,0,1]=4