0 B10R0.3 CC(=O)CCNC(=O)CCO AIFCHEM-6235626848 [0,0,0,0,0,0|3,0,1]=4 1 B10R0.3 CSCC(=O)NCCC(C)C AIFCHEM-6098985804 [0,0,0,0,0,0|2,0,0]=2 2 B9R0.1 C#CC(=O)NCCC(C)C AIFCHEM-94525199807 [1,0,0,0,0,0|1,0,2]=4 3 B9R0.1 CCC(=O)NCCC(C)C AIFCHEM-94526508254 [1,0,0,0,0,0|1,0,0]=2 4 B9R0.2 CCCCCNCC(C)C AIFCHEM-94563719037 [1,0,0,0,0,0|2,0,1]=4 5 B9R0.2 CCCNCCOC(C)C AIFCHEM-94569022755 [1,0,0,0,0,0|3,0,0]=4 6 B9R0.5 CCNCCC(=O)OCC AIFCHEM-94537421553 [1,0,0,0,0,0|3,0,0]=4 7 B9R0.5 CSCCNC(=O)CSC AIFCHEM-94598929502 [1,0,0,0,0,0|3,0,0]=4 8 B11R0.1 CSCC(=O)NC(C)CN(C)C AIFCHEM-6080632422 [0,1,0,0,0,0|3,0,0]=4 9 B11R0.6 CC(=O)CCNC(=O)CC(C)C AIFCHEM-6195449918 [0,1,0,0,0,0|2,0,1]=4 10 B11R0.6 CC(C)CC(=O)NCCC(F)F AIFCHEM-6232449177 [0,1,0,0,0,0|3,0,0]=4 11 B11R0.6 CC(C)CCNC(=O)CN(C)C AIFCHEM-94594499392 [0,1,0,0,0,0|2,0,0]=3 12 B11R0.6 CC(C)COCC(=O)NC(C)C AIFCHEM-94520547301 [0,1,0,0,0,0|3,0,0]=4 13 B11R0.6 CC(O)CC(=O)NCCN(C)C AIFCHEM-5950268475 [0,1,0,0,0,0|2,0,0]=3 14 B11R0.6 CN(C)CCNC(=O)CC(F)F AIFCHEM-5915519621 [0,1,0,0,0,0|3,0,0]=4 15 B11R0.6 C[C@@H](O)CC(=O)NCCN(C)C AIFCHEM-94537685879 [0,1,0,0,0,0|2,0,0]=3 16 B11R0.6 C[C@H](O)CC(=O)NCCN(C)C AIFCHEM-94537685818 [0,1,0,0,0,0|2,0,0]=3 17 B11R0.59 CC(C)CCN(C)C(=O)CC#N AIFCHEM-94559915903 [0,1,0,0,0,0|2,0,1]=4 18 B11R0.59 CC(C)CCN(C)C(=O)CCO AIFCHEM-6150352724 [0,1,0,0,0,0|2,0,0]=3 19 B11R0.59 CCCN(C)C(=O)CCC(C)C AIFCHEM-5860600147 [0,1,0,0,0,0|3,0,0]=4 20 B11R0.59 CN(C)CCN(C)C(=O)CCO AIFCHEM-94528268108 [0,1,0,0,0,0|3,0,0]=4 21 B11R0.59 COCC(=O)N(C)CCN(C)C AIFCHEM-94528269059 [0,1,0,0,0,0|3,0,0]=4 22 B11R0.59 CSCC(=O)N(C)CCC(C)C AIFCHEM-6150176135 [0,1,0,0,0,0|2,0,0]=3 23 B11R0.141 CCNC(=O)CNC(C)C(C)C AIFCHEM-94522512068 [0,1,0,0,0,0|3,0,0]=4 24 B11R0.145 CCC(C)C(=O)NCC=C(C)C AIFCHEM-5943809879 [0,1,0,0,0,0|1,0,2]=4 25 B11R0.145 CCC(C)C(=O)NCCN(C)C AIFCHEM-5915312132 [0,1,0,0,0,0|2,0,0]=3 26 B11R0.145 CC[C@@H](C)C(=O)NCC=C(C)C AIFCHEM-94550257162 [0,1,0,0,0,0|1,0,2]=4 27 B11R0.145 CC[C@@H](C)C(=O)NCCN(C)C AIFCHEM-94537683692 [0,1,0,0,0,0|2,0,0]=3 28 B11R0.145 CC[C@H](C)C(=O)NCC=C(C)C AIFCHEM-94550254951 [0,1,0,0,0,0|1,0,2]=4 29 B11R0.145 CC[C@H](C)C(=O)NCCN(C)C AIFCHEM-94537681481 [0,1,0,0,0,0|2,0,0]=3 30 B11R0.147 C/C=C/CC(=O)NCCC(C)C AIFCHEM-6133136178 [0,1,0,0,0,0|1,0,1]=3 31 B11R0.147 C/C=C/CC(=O)NCCN(C)C AIFCHEM-94537681195 [0,1,0,0,0,0|2,0,1]=4 32 B11R0.147 CCOCC(=O)NCCC(=O)C AIFCHEM-6219569267 [0,1,0,0,0,0|2,0,1]=4 33 B11R0.147 CCOCC(=O)NCCC(F)F AIFCHEM-6215019294 [0,1,0,0,0,0|3,0,0]=4 34 B11R0.147 CCSCC(=O)NCCC(F)F AIFCHEM-94580209287 [0,1,0,0,0,0|3,0,0]=4 35 B11R0.147 CCSCC(=O)NCCN(C)C AIFCHEM-94537685891 [0,1,0,0,0,0|2,0,0]=3 36 B11R0.147 CSCCC(=O)NCC=C(C)C AIFCHEM-5968889448 [0,1,0,0,0,0|1,0,2]=4 37 B11R0.147 CSCCC(=O)NCCC(F)F AIFCHEM-6189835587 [0,1,0,0,0,0|3,0,0]=4 38 B11R0.174 CCCC(C)NCCC(C)CO AIFCHEM-94606118471 [0,1,0,0,0,0|2,0,1]=4 39 B11R0.174 CCCC(C)NCCC(C)SC AIFCHEM-94560471461 [0,1,0,0,0,0|2,0,1]=4 40 B11R0.174 CCC[C@@H](C)NCCC(C)SC AIFCHEM-6081678009 [0,1,0,0,0,0|2,0,1]=4 41 B11R0.174 CCC[C@H](C)NCCC(C)SC AIFCHEM-5628494798 [0,1,0,0,0,0|2,0,1]=4 42 B11R0.174 CCOC(=O)CCNC(C)CO AIFCHEM-6056632063 [0,1,0,0,0,0|3,0,0]=4 43 B11R1.15 CC1CCN(C1)C(=O)CC#N AIFCHEM-94559911158 [0,0,0,1,0,0|2,0,1]=4 44 B11R1.15 CCCC(C)N1CCC(C1)C AIFCHEM-94606109985 [0,0,0,1,0,0|2,0,1]=4 45 B11R1.15 CCCC(C)N1CC[C@@H](C1)C AIFCHEM-94606114098 [0,0,0,1,0,0|2,0,1]=4 46 B11R1.15 CCCC(C)N1CC[C@H](C1)C AIFCHEM-94606115634 [0,0,0,1,0,0|2,0,1]=4 47 B11R1.15 CSCC(=O)N1CCC(C1)C AIFCHEM-5638966097 [0,0,0,1,0,0|2,0,0]=3 48 B11R1.15 CSCC(=O)N1CC[C@@H](C1)C AIFCHEM-5610803874 [0,0,0,1,0,0|2,0,0]=3 49 B11R1.15 CSCC(=O)N1CC[C@H](C1)C AIFCHEM-5820243048 [0,0,0,1,0,0|2,0,0]=3 50 B11R1.15 C[C@@H]1CCN(C1)C(=O)CC#N AIFCHEM-94559915791 [0,0,0,1,0,0|2,0,1]=4 51 B11R1.15 C[C@H]1CCN(C1)C(=O)CC#N AIFCHEM-94559914545 [0,0,0,1,0,0|2,0,1]=4 52 B11R1.124 CCCN1CC[C@@H](C1)C(C)C AIFCHEM-94569014699 [0,0,0,1,0,0|3,0,0]=4 53 B11R1.201 COCC(=O)NC1CC(C1)F AIFCHEM-6126563508 [0,0,0,1,0,0|3,0,0]=4 54 B11R1.201 COCC(=O)N[C@H]1C[C@@H](C1)F AIFCHEM-5891541933 [0,0,0,1,0,0|3,0,0]=4 55 B11R1.288 CCCC(C)NC[C@@H]1C[C@H]1C AIFCHEM-94606114363 [0,0,0,1,0,0|2,0,1]=4 56 B11R1.290 CCOC(=O)CNCC1CC1 AIFCHEM-5643711363 [0,0,0,1,0,0|3,0,0]=4 57 B9R0.48 C#CCC(=O)NCC(C)C AIFCHEM-94563729590 [0,0,0,0,1,0|1,0,2]=4 58 B9R0.48 CC(C)CNC(=O)CCO AIFCHEM-94563731697 [0,0,0,0,1,0|2,0,0]=3 59 B9R0.48 CCCN(C)CCC(C)C AIFCHEM-94569016119 [0,0,0,0,1,0|2,0,0]=3 60 B11R0.176 CC(C)OCCNC(=O)CCO AIFCHEM-6282628800 [0,0,0,0,0,1|2,0,0]=3 61 B11R0.176 CCNC(=O)CNCCN(C)C AIFCHEM-94564768368 [0,0,0,0,0,1|3,0,0]=4 62 B8R0.6 CCC(=O)NCCOC AIFCHEM-94526499594 [2,0,0,0,0,0|2,0,0]=4 63 B8R0.7 CCCCNCC(C)C AIFCHEM-94570975038 [2,0,0,0,0,0|1,0,1]=4 64 B8R0.28 CC(=O)NCCN(C)C AIFCHEM-5916242960 [2,0,0,0,0,0|2,0,0]=4 65 B8R0.1 CCCCN(C)CCC AIFCHEM-94523040043 [2,0,0,0,0,0|2,0,0]=4 66 B8R0.1 CCCNC(=O)COC AIFCHEM-5791287162 [2,0,0,0,0,0|2,0,0]=4 67 B10R0.57 CCC(=O)N(C)CCC(C)C AIFCHEM-94526505359 [1,1,0,0,0,0|1,0,0]=3 68 B10R0.60 CC(C)(C)CCNC(=O)CO AIFCHEM-94532681324 [1,1,0,0,0,0|2,0,0]=4 69 B10R0.98 CC(C)CCNC(=O)C(C)O AIFCHEM-94571307470 [1,1,0,0,0,0|1,0,0]=3 70 B10R0.98 CC(C)CCNC(=O)[C@@H](C)O AIFCHEM-6132300811 [1,1,0,0,0,0|1,0,0]=3 71 B10R0.98 CC(C)CCNC(=O)[C@H](C)O AIFCHEM-6184219537 [1,1,0,0,0,0|1,0,0]=3 72 B10R0.4 CCCCCCNCC(C)C AIFCHEM-94572974669 [1,1,0,0,0,0|1,0,1]=4 73 B10R0.55 CCC(C)CNCCC(C)C AIFCHEM-6121185674 [1,1,0,0,0,0|1,0,1]=4 74 B10R0.74 CCCCNCCC(C)CO AIFCHEM-94523038052 [1,1,0,0,0,0|1,0,1]=4 75 B10R0.75 CCCCNCC(O)C(C)C AIFCHEM-94523035587 [1,1,0,0,0,0|1,0,1]=4 76 B10R0.97 CC(C)CCCNCC(C)C AIFCHEM-94572971938 [1,1,0,0,0,0|2,0,0]=4 77 B10R0.1 CCCCCNC(=O)CCO AIFCHEM-94522662823 [1,1,0,0,0,0|2,0,0]=4 78 B10R0.1 CCCCNCC(=O)NCC AIFCHEM-94523039937 [1,1,0,0,0,0|2,0,0]=4 79 B10R0.1 CCSCCNC(=O)COC AIFCHEM-6081902451 [1,1,0,0,0,0|2,0,0]=4 80 B10R0.1 COCCCNC(=O)CCO AIFCHEM-5663800686 [1,1,0,0,0,0|2,0,0]=4 81 B10R0.2 CCCC(C)NC(=O)CSC AIFCHEM-94560480694 [1,1,0,0,0,0|2,0,0]=4 82 B10R0.2 CCC[C@@H](C)NC(=O)CSC AIFCHEM-6086409625 [1,1,0,0,0,0|2,0,0]=4 83 B10R0.2 CCC[C@H](C)NC(=O)CSC AIFCHEM-5590498300 [1,1,0,0,0,0|2,0,0]=4 84 B10R0.83 CCCCNC(=O)C(O)CO AIFCHEM-5752192535 [1,1,0,0,0,0|2,0,0]=4 85 B10R0.91 CCCCC(=O)NCCOC AIFCHEM-94534100236 [1,1,0,0,0,0|2,0,0]=4 86 B10R0.91 CCCCC(=O)NCCSC AIFCHEM-94534104594 [1,1,0,0,0,0|2,0,0]=4 87 B10R0.91 CCCCNC(=O)CCSC AIFCHEM-5695482106 [1,1,0,0,0,0|1,0,0]=3 88 B10R0.108 CCC(F)CNC(=O)COC AIFCHEM-5870225166 [1,1,0,0,0,0|2,0,0]=4 89 B10R0.26 CSCC(=O)NC(C)C(C)C AIFCHEM-6232466386 [0,1,0,0,1,0|2,0,0]=4 90 B10R0.26 CSCC(=O)N[C@H](C)C(C)C AIFCHEM-94576828229 [0,1,0,0,1,0|2,0,0]=4 91 B10R0.32 CSCC(=O)N(C)CC(C)C AIFCHEM-5711700425 [0,1,0,0,1,0|2,0,0]=4 92 B10R0.96 CC(C)CCC(=O)NC(C)C AIFCHEM-94520550426 [0,1,0,0,1,0|1,0,0]=3 93 B10R0.96 CC(C)CNC(=O)CC(C)C AIFCHEM-94563731698 [0,1,0,0,1,0|1,0,0]=3 94 B10R0.96 CC(C)CNC(=O)CN(C)C AIFCHEM-94563729771 [0,1,0,0,1,0|2,0,0]=4 95 B10R0.96 CC(C)NC(=O)COC(C)C AIFCHEM-94520548216 [0,1,0,0,1,0|2,0,0]=4 96 B10R0.96 CC(C)NC(=O)CSC(C)C AIFCHEM-94520547139 [0,1,0,0,1,0|2,0,0]=4 97 B10R0.109 CC(C)(F)CNC(=O)CCO AIFCHEM-5712423119 [0,1,0,0,1,0|2,0,0]=4 98 B10R0.109 CCCN(C)CCC(C)(C)C AIFCHEM-5808482214 [0,1,0,0,1,0|2,0,0]=4 99 B12R0.72 CCOC(=O)CNCCC(C)(C)C AIFCHEM-5616168537 [0,1,0,0,0,1|2,0,0]=4 100 B12R0.86 CC(C)OCCNC(=O)C(O)CO AIFCHEM-6282588829 [0,1,0,0,0,1|2,0,0]=4 101 B12R0.86 CCC(C)C(=O)NCCCC(C)C AIFCHEM-5746595577 [0,1,0,0,0,1|1,0,0]=3 102 B12R0.86 CC[C@@H](C)C(=O)NCCCC(C)C AIFCHEM-5738802165 [0,1,0,0,0,1|1,0,0]=3 103 B12R0.86 CC[C@H](C)C(=O)NCCCC(C)C AIFCHEM-5728556284 [0,1,0,0,0,1|1,0,0]=3 104 B12R0.86 COC(C)C(=O)NCCOC(C)C AIFCHEM-6254639142 [0,1,0,0,0,1|2,0,0]=4 105 B12R0.86 CO[C@@H](C)C(=O)NCCOC(C)C AIFCHEM-6271261283 [0,1,0,0,0,1|2,0,0]=4 106 B12R0.86 CO[C@H](C)C(=O)NCCOC(C)C AIFCHEM-6254328365 [0,1,0,0,0,1|2,0,0]=4 107 B12R0.95 C#CCCC(=O)NCCCC(C)C AIFCHEM-5695027673 [0,1,0,0,0,1|1,0,1]=4 108 B12R0.95 CC(C)OCCNC(=O)CCC#N AIFCHEM-6227929924 [0,1,0,0,0,1|1,0,1]=4 109 B12R0.95 CCCCC(=O)NCCOC(C)C AIFCHEM-94534111292 [0,1,0,0,0,1|1,0,0]=3 110 B12R0.95 CCCNC(=O)CCCCC(C)C AIFCHEM-5791125063 [0,1,0,0,0,1|1,0,0]=3 111 B12R0.95 CCCNC(=O)CCCCN(C)C AIFCHEM-94541850413 [0,1,0,0,0,1|2,0,0]=4 112 B12R0.95 CCOCC(=O)NCCCC(C)C AIFCHEM-5701305724 [0,1,0,0,0,1|1,0,0]=3 113 B12R0.95 CCSCC(=O)NCCCC(C)C AIFCHEM-94580210374 [0,1,0,0,0,1|1,0,0]=3 114 B12R0.95 CCSCC(=O)NCCOC(C)C AIFCHEM-94580220960 [0,1,0,0,0,1|1,0,0]=3 115 B12R0.95 COCCC(=O)NCCCC(C)C AIFCHEM-5738429934 [0,1,0,0,0,1|1,0,0]=3 116 B12R0.95 COCCC(=O)NCCCN(C)C AIFCHEM-94584130892 [0,1,0,0,0,1|2,0,0]=4 117 B12R0.95 CSCCC(=O)NCCCN(C)C AIFCHEM-5785021416 [0,1,0,0,0,1|2,0,0]=4 118 B12R0.270 CC(C)CCCCC(=O)NC(C)C AIFCHEM-94520552204 [0,1,0,0,0,1|2,0,0]=4 119 B12R0.270 CC(C)OCCNC(=O)CC(F)F AIFCHEM-6282496659 [0,1,0,0,0,1|2,0,0]=4 120 B12R0.270 CC(O)CC(=O)NCCCN(C)C AIFCHEM-5766583431 [0,1,0,0,0,1|2,0,0]=4 121 B12R0.270 C[C@@H](O)CC(=O)NCCCN(C)C AIFCHEM-94584133681 [0,1,0,0,0,1|2,0,0]=4 122 B12R0.270 C[C@H](O)CC(=O)NCCCN(C)C AIFCHEM-94584133620 [0,1,0,0,0,1|2,0,0]=4 123 B12R0.279 CCOC(=O)CCNC(C)C(C)C AIFCHEM-94522509997 [0,1,0,0,0,1|2,0,0]=4 124 B12R0.2 CCCCC(=O)NC(C)CN(C)C AIFCHEM-94534110896 [0,2,0,0,0,0|2,0,0]=4 125 B12R0.66 CN(C)CC(=O)NCCC(C)(C)C AIFCHEM-6276709526 [0,2,0,0,0,0|2,0,0]=4 126 B12R0.140 CC(C)CCNC(=O)CC(C)(C)O AIFCHEM-6098965151 [0,2,0,0,0,0|1,0,0]=3 127 B12R0.240 CCC(C)CC(=O)NCCC(C)C AIFCHEM-6095155045 [0,2,0,0,0,0|1,0,0]=3 128 B12R0.240 CCC(C)CC(=O)NCCN(C)C AIFCHEM-5916344185 [0,2,0,0,0,0|2,0,0]=4 129 B12R0.240 CC[C@H](C)CC(=O)NCCC(C)C AIFCHEM-6094426810 [0,2,0,0,0,0|1,0,0]=3 130 B12R0.240 CC[C@H](C)CC(=O)NCCN(C)C AIFCHEM-5962195030 [0,2,0,0,0,0|2,0,0]=4 131 B12R0.240 COC(=O)CC(=O)NCCC(C)C AIFCHEM-94549713040 [0,2,0,0,0,0|1,0,1]=4 132 B12R0.258 CC(C)CCN(C)C(=O)CC(C)C AIFCHEM-6097886717 [0,2,0,0,0,0|1,0,0]=3 133 B12R0.77 CCN(CCC(C)C)C(=O)CCO AIFCHEM-100186798957 [0,2,0,0,0,0|2,0,0]=4 134 B12R0.77 CCN(CCC(C)C)C(=O)COC AIFCHEM-94954768960 [0,2,0,0,0,0|2,0,0]=4 135 B12R0.77 CCN(CCC(C)C)C(=O)CSC AIFCHEM-98578547653 [0,2,0,0,0,0|2,0,0]=4 136 B12R0.88 CCC(C)C(=O)N(C)CCC(C)C AIFCHEM-6096845350 [0,2,0,0,0,0|1,0,0]=3 137 B12R0.88 CC[C@@H](C)C(=O)N(C)CCC(C)C AIFCHEM-6097619701 [0,2,0,0,0,0|1,0,0]=3 138 B12R0.88 CC[C@H](C)C(=O)N(C)CCC(C)C AIFCHEM-6167779532 [0,2,0,0,0,0|1,0,0]=3 139 B12R0.349 CC(C)CCNC(=O)C(C)(C)CF AIFCHEM-6121656791 [0,2,0,0,0,0|2,0,0]=4 140 B12R0.349 COC(C)(C)C(=O)NCCC(C)C AIFCHEM-6136039770 [0,2,0,0,0,0|2,0,0]=4 141 B12R0.677 CCC(CC)C(=O)NCCC(C)C AIFCHEM-6132315163 [0,2,0,0,0,0|1,0,0]=3 142 B12R0.44 CC(=O)SCC(=O)NCCC(C)C AIFCHEM-94528298303 [0,2,0,0,0,0|1,0,1]=4 143 B12R0.44 CC(C)CCNC(=O)COC(F)F AIFCHEM-6135484397 [0,2,0,0,0,0|2,0,0]=4 144 B12R0.44 CC(C)CNC(=O)COCC(C)C AIFCHEM-6123119495 [0,2,0,0,0,0|2,0,0]=4 145 B12R0.44 CC(C)SCC(=O)NCCN(C)C AIFCHEM-5949585678 [0,2,0,0,0,0|2,0,0]=4 146 B12R0.104 C#CCCC(=O)NCCC(C)(C)C AIFCHEM-6241558195 [0,2,0,0,0,0|1,0,1]=4 147 B12R0.104 CCCCC(=O)NCCC(C)(C)C AIFCHEM-94534106761 [0,2,0,0,0,0|1,0,0]=3 148 B12R0.233 CC#CCNC(=O)CCCC(C)C AIFCHEM-5693764377 [0,2,0,0,0,0|1,0,1]=4 149 B12R0.233 CC(C)CCNC(=O)C#CCCO AIFCHEM-6121651994 [0,2,0,0,0,0|1,0,1]=4 150 B12R0.233 CCCOCC(=O)NCCC(C)C AIFCHEM-6132874757 [0,2,0,0,0,0|1,0,0]=3 151 B12R0.233 COCCNC(=O)CCCN(C)C AIFCHEM-94526553614 [0,2,0,0,0,0|2,0,0]=4 152 B12R0.573 COCC(=O)NCCC(C)(C)OC AIFCHEM-5883016252 [0,2,0,0,0,0|2,0,0]=4 153 B10R1.14 CC1CCN(C1)C(=O)CO AIFCHEM-94532675819 [1,0,0,1,0,0|2,0,0]=4 154 B10R1.14 CCC(=O)N1CCC(C1)F AIFCHEM-94526503398 [1,0,0,1,0,0|2,0,0]=4 155 B10R1.14 CCC(=O)N1CC[C@@H](C1)F AIFCHEM-94526501929 [1,0,0,1,0,0|2,0,0]=4 156 B10R1.14 CCC(=O)N1CC[C@H](C1)F AIFCHEM-94526501930 [1,0,0,1,0,0|2,0,0]=4 157 B10R1.14 C[C@@H]1CCN(C1)C(=O)CO AIFCHEM-94532680452 [1,0,0,1,0,0|2,0,0]=4 158 B10R1.14 C[C@H]1CCN(C1)C(=O)CO AIFCHEM-5610242291 [1,0,0,1,0,0|2,0,0]=4 159 B10R1.150 CC1CC(C1)NC(=O)CO AIFCHEM-94532686731 [1,0,0,1,0,0|2,0,0]=4 160 B10R1.150 CCC(=O)NC1CC(C1)C AIFCHEM-94526511526 [1,0,0,1,0,0|1,0,0]=3 161 B10R1.150 CCC(=O)NC1CC(C1)F AIFCHEM-94526501421 [1,0,0,1,0,0|2,0,0]=4 162 B10R1.150 CCC(=O)N[C@H]1C[C@@H](C1)F AIFCHEM-94526502226 [1,0,0,1,0,0|2,0,0]=4 163 B10R1.150 CCC(=O)N[C@H]1C[C@H](C1)F AIFCHEM-94526502225 [1,0,0,1,0,0|2,0,0]=4 164 B10R1.56 CCCCNC[C@@H]1C[C@H]1C AIFCHEM-94523033944 [1,0,0,1,0,0|1,0,1]=4 165 B10R1.133 CCCN1CCCC1(C)C AIFCHEM-94522224602 [1,0,0,1,0,0|2,0,0]=4 166 B10R1.139 COCC(=O)N1CC[C@@H]1C AIFCHEM-5744895297 [1,0,0,1,0,0|2,0,0]=4 167 B10R1.139 COCC(=O)N1CC[C@H]1C AIFCHEM-6231289902 [1,0,0,1,0,0|2,0,0]=4 168 B10R1.1 CCCN1CCC(CC1)C AIFCHEM-94569020796 [0,0,0,1,1,0|2,0,0]=4 169 B12R1.17 CC1CCCN(C1)C(=O)CCO AIFCHEM-94534158742 [0,0,0,1,0,1|2,0,0]=4 170 B12R1.17 CSCC(=O)N1CCSC(C1)C AIFCHEM-94534782470 [0,0,0,1,0,1|2,0,0]=4 171 B12R1.17 C[C@H]1CCCN(C1)C(=O)CCO AIFCHEM-94598406823 [0,0,0,1,0,1|2,0,0]=4 172 B12R1.317 CSCC(=O)N1CCSC1(C)C AIFCHEM-5687085961 [0,0,0,1,0,1|2,0,0]=4 173 B12R1.317 CSCC(=O)N1COCC1(C)C AIFCHEM-5739134443 [0,0,0,1,0,1|2,0,0]=4 174 B12R1.874 CC(C)CN1CCCNC(=O)C1 AIFCHEM-94572987126 [0,1,0,1,0,0|2,0,0]=4 175 B12R1.1061 CC1CC(C1)NC(=O)CN(C)C AIFCHEM-94594502664 [0,1,0,1,0,0|2,0,0]=4 176 B12R1.103 CC(C)CC(=O)N1CCC(C1)C AIFCHEM-5614208004 [0,1,0,1,0,0|1,0,0]=3 177 B12R1.103 CC(C)CC(=O)N1CC[C@@H](C1)C AIFCHEM-5610650673 [0,1,0,1,0,0|1,0,0]=3 178 B12R1.1359 CC(C)CCNC(=O)CC1CC1 AIFCHEM-6135193245 [0,1,0,1,0,0|1,0,0]=3 179 B12R1.1359 CC(C)CNCC(=O)NC1CC1 AIFCHEM-94572983595 [0,1,0,1,0,0|2,0,0]=4 180 B12R1.1580 COCC(=O)N1CCC(C1)(C)C AIFCHEM-5720690405 [0,1,0,1,0,0|2,0,0]=4 181 B12R1.469 CC[C@@H](C)C(=O)NC1CC(C1)C AIFCHEM-6163326307 [0,1,0,1,0,0|1,0,0]=3 182 B12R1.469 CC[C@H](C)C(=O)NC1CC(C1)C AIFCHEM-6142477918 [0,1,0,1,0,0|1,0,0]=3 183 B12R1.469 COC(C)C(=O)NC1CC(C1)C AIFCHEM-6154126241 [0,1,0,1,0,0|2,0,0]=4 184 B12R1.469 CO[C@@H](C)C(=O)NC1CC(C1)C AIFCHEM-6090817564 [0,1,0,1,0,0|2,0,0]=4 185 B12R1.469 CO[C@H](C)C(=O)NC1CC(C1)C AIFCHEM-6154024511 [0,1,0,1,0,0|2,0,0]=4 186 B12R1.471 COC(C)C(=O)NCCC1CC1 AIFCHEM-5772616372 [0,1,0,1,0,0|2,0,0]=4 187 B12R1.471 CO[C@@H](C)C(=O)NCCC1CC1 AIFCHEM-5764229986 [0,1,0,1,0,0|2,0,0]=4 188 B12R1.471 CO[C@H](C)C(=O)NCCC1CC1 AIFCHEM-5784299801 [0,1,0,1,0,0|2,0,0]=4 189 B12R1.839 COC(C)C(=O)NC[C@@H]1C[C@H]1C AIFCHEM-94599426014 [0,1,0,1,0,0|2,0,0]=4 190 B12R1.839 CO[C@H](C)C(=O)NC[C@@H]1C[C@H]1C AIFCHEM-94599424368 [0,1,0,1,0,0|2,0,0]=4 191 B12R1.839 C[C@@H]1C[C@H]1CNC(=O)C(O)CO AIFCHEM-94599426208 [0,1,0,1,0,0|2,0,0]=4 192 B12R1.1357 CC(C)CCNC(=O)[C@@H]1CCO1 AIFCHEM-6121630100 [0,1,0,1,0,0|1,0,0]=3 193 B12R1.1357 CN(C)CCNC(=O)C1CCC1 AIFCHEM-94572513426 [0,1,0,1,0,0|2,0,0]=4 194 B12R1.1357 CN(C)CCNC(=O)C1COC1 AIFCHEM-94536798445 [0,1,0,1,0,0|2,0,0]=4 195 B12R1.29 C#CCCC(=O)N1CCC(C1)C AIFCHEM-5637338297 [0,1,0,1,0,0|1,0,1]=4 196 B12R1.29 C#CCCC(=O)N1CC[C@@H](C1)C AIFCHEM-5632180358 [0,1,0,1,0,0|1,0,1]=4 197 B12R1.29 C#CCCC(=O)N1CC[C@H](C1)C AIFCHEM-5791683386 [0,1,0,1,0,0|1,0,1]=4 198 B12R1.29 CC1CCN(C1)C(=O)CCC#N AIFCHEM-5683575615 [0,1,0,1,0,0|1,0,1]=4 199 B12R1.29 CCCNC(=O)C1CCN(C1)C AIFCHEM-94582079884 [0,1,0,1,0,0|2,0,0]=4 200 B12R1.29 CSCCC(=O)N1CC[C@@H](C1)F AIFCHEM-5635124818 [0,1,0,1,0,0|2,0,0]=4 201 B12R1.29 CSCCC(=O)N1CC[C@H](C1)F AIFCHEM-5648119102 [0,1,0,1,0,0|2,0,0]=4 202 B12R1.29 C[C@@H]1CCN(C1)C(=O)CCC#N AIFCHEM-5843068810 [0,1,0,1,0,0|1,0,1]=4 203 B12R1.462 CCCCC(=O)NC1CN(C1)C AIFCHEM-94534100505 [0,1,0,1,0,0|2,0,0]=4 204 B12R1.462 CCOCC(=O)NC1CN(C1)C AIFCHEM-94533077542 [0,1,0,1,0,0|2,0,0]=4 205 B12R1.462 CSCCC(=O)NC1CC(C1)F AIFCHEM-6107709697 [0,1,0,1,0,0|2,0,0]=4 206 B12R1.462 CSCCC(=O)N[C@H]1C[C@@H](C1)F AIFCHEM-5891228985 [0,1,0,1,0,0|2,0,0]=4 207 B12R1.462 CSCCC(=O)N[C@H]1C[C@H](C1)F AIFCHEM-5968015164 [0,1,0,1,0,0|2,0,0]=4 208 B12R1.464 CCCOC(=O)CNCC1CC1 AIFCHEM-94602830846 [0,1,0,1,0,0|2,0,0]=4 209 B12R1.464 CCSCC(=O)NCCC1CC1 AIFCHEM-94580221837 [0,1,0,1,0,0|1,0,0]=3 210 B12R1.549 C/C=C/CC(=O)NC[C@@H]1C[C@H]1C AIFCHEM-94599422681 [0,1,0,1,0,0|1,0,1]=4 211 B12R1.549 C[C@@H]1C[C@H]1CNC(=O)CCC#N AIFCHEM-94599422651 [0,1,0,1,0,0|1,0,1]=4 212 B12R1.312 COC1CCN(C1)C(=O)CCO AIFCHEM-94564298255 [0,1,0,1,0,0|2,0,0]=4 213 B12R1.312 CO[C@@H]1CCN(C1)C(=O)CCO AIFCHEM-94603552489 [0,1,0,1,0,0|2,0,0]=4 214 B12R1.312 CO[C@H]1CCN(C1)C(=O)CCO AIFCHEM-94577859486 [0,1,0,1,0,0|2,0,0]=4 215 B12R1.3183 CC(C)(C)CCNC(=O)C1CC1 AIFCHEM-6202785283 [0,1,0,1,0,0|1,0,0]=3 216 B12R2.1472 COCC(=O)N1CC2CC1C2 AIFCHEM-5687596094 [0,0,0,2,0,0|2,0,0]=4 217 B12R2.1488 O=C(CCO)N1CC2CC2C1 AIFCHEM-94584692174 [0,0,0,2,0,0|2,0,0]=4 218 B12R2.665 O=C(NC1CC(C1)F)C2CC2 AIFCHEM-6108135008 [0,0,0,2,0,0|2,0,0]=4 219 B12R2.665 O=C(N[C@H]1C[C@@H](C1)F)C2CC2 AIFCHEM-5890114269 [0,0,0,2,0,0|2,0,0]=4 220 B12R2.665 O=C(N[C@H]1C[C@H](C1)F)C2CC2 AIFCHEM-5948712963 [0,0,0,2,0,0|2,0,0]=4 221 B8R0.9 CC(C)CNC(=O)CO AIFCHEM-94532683064 [1,0,0,0,1,0|2,0,0]=4 222 B8R0.5 COCC(=O)NC(C)C AIFCHEM-94520550271 [0,0,0,0,2,0|2,0,0]=4 223 B8R0.5 CSCC(=O)NC(C)C AIFCHEM-94520547347 [0,0,0,0,2,0|2,0,0]=4