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AIFCHEM-94535593052 [1,0,0,0,0,0|2,0,0]=3 16 B8R0.7 CSCCCNC(=O)C AIFCHEM-94535596324 [1,0,0,0,0,0|2,0,0]=3 17 B10R0.1 CCCCCNC(=O)CC#N AIFCHEM-94559920597 [0,1,0,0,0,0|1,0,1]=3 18 B10R0.1 CCCCCNC(=O)CCO AIFCHEM-94522662823 [0,1,0,0,0,0|1,0,0]=2 19 B10R0.1 CCCCNCC(=O)NCC AIFCHEM-94523039937 [0,1,0,0,0,0|1,0,0]=2 20 B10R0.1 CCSCCNC(=O)COC AIFCHEM-6081902451 [0,1,0,0,0,0|2,0,0]=3 21 B10R0.1 COCCCNC(=O)CCO AIFCHEM-5663800686 [0,1,0,0,0,0|2,0,0]=3 22 B10R0.18 CCCCN(C)CC(C)CC AIFCHEM-94523030673 [0,1,0,0,0,0|2,0,1]=4 23 B10R0.18 CCCNC(C)CC(=O)OC AIFCHEM-94569011981 [0,1,0,0,0,0|2,0,0]=3 24 B10R0.18 CCCN[C@@H](C)CC(=O)OC AIFCHEM-94569012180 [0,1,0,0,0,0|2,0,0]=3 25 B10R0.18 CCCN[C@H](C)CC(=O)OC AIFCHEM-94569008681 [0,1,0,0,0,0|2,0,0]=3 26 B10R0.41 CCCCCNC(CC)CO AIFCHEM-94552821569 [0,1,0,0,0,0|1,0,2]=4 27 B10R0.41 CCCCCN[C@@H](CC)CO AIFCHEM-94551434740 [0,1,0,0,0,0|1,0,2]=4 28 B10R0.41 CCCCCN[C@H](CC)CO AIFCHEM-94551434741 [0,1,0,0,0,0|1,0,2]=4 29 B10R0.41 CCNCCCN(CC)CC AIFCHEM-94537411693 [0,1,0,0,0,0|3,0,0]=4 30 B10R0.55 C#CC(=O)NCCCC(C)C AIFCHEM-94525191617 [0,1,0,0,0,0|1,0,2]=4 31 B10R0.55 CCC(=O)NCCCC(C)C AIFCHEM-94526500064 [0,1,0,0,0,0|1,0,0]=2 32 B10R0.55 CCC(=O)NCCOC(=O)C AIFCHEM-94526504575 [0,1,0,0,0,0|2,0,1]=4 33 B10R0.55 CCC(C)CNCCC(C)C AIFCHEM-6121185674 [0,1,0,0,0,0|2,0,1]=4 34 B10R0.55 CN(C)CCCNC(=O)CO AIFCHEM-5766450913 [0,1,0,0,0,0|3,0,0]=4 35 B10R0.59 CCC(=O)NCCC(=O)OC AIFCHEM-94526506245 [0,1,0,0,0,0|2,0,1]=4 36 B10R0.59 CCC(C)CNCC(O)CC AIFCHEM-6457096569 [0,1,0,0,0,0|1,0,2]=4 37 B10R0.59 CCC(C)CNC[C@H](O)CC AIFCHEM-6462673825 [0,1,0,0,0,0|1,0,2]=4 38 B10R0.59 CNC(=O)CNCC(O)CO AIFCHEM-94562544278 [0,1,0,0,0,0|3,0,0]=4 39 B10R0.59 CNC(=O)CNC[C@H](O)CO AIFCHEM-94562543721 [0,1,0,0,0,0|3,0,0]=4 40 B10R0.74 C#CCCCCNC(=O)CC AIFCHEM-94526502812 [0,1,0,0,0,0|0,0,2]=3 41 B10R0.74 CCC(C)CNCCCCO AIFCHEM-6503161781 [0,1,0,0,0,0|2,0,1]=4 42 B10R0.74 CCCCCNCC(C)CC AIFCHEM-94522656373 [0,1,0,0,0,0|1,0,1]=3 43 B10R0.74 CCCCCNCC(F)CC AIFCHEM-94551426530 [0,1,0,0,0,0|1,0,1]=3 44 B10R0.74 CCCCCNC[C@@H](F)CO AIFCHEM-94551432028 [0,1,0,0,0,0|2,0,1]=4 45 B10R0.74 CCCCCNC[C@H](F)CO AIFCHEM-94551432029 [0,1,0,0,0,0|2,0,1]=4 46 B10R0.74 CCCCNCCC(C)CO AIFCHEM-94523038052 [0,1,0,0,0,0|2,0,1]=4 47 B10R0.74 COC(=O)CNCCCSC AIFCHEM-94546184206 [0,1,0,0,0,0|2,0,0]=3 48 B10R0.75 C#CCCCNC(=O)C(C)C AIFCHEM-94545045042 [0,1,0,0,0,0|1,0,2]=4 49 B10R0.75 CCCCCCN(C)C(=O)C AIFCHEM-94535595676 [0,1,0,0,0,0|2,0,1]=4 50 B10R0.75 CCCCCNC(=O)C(C)O AIFCHEM-94571298865 [0,1,0,0,0,0|1,0,0]=2 51 B10R0.75 CCCCCNC(=O)[C@@H](C)O AIFCHEM-94522656682 [0,1,0,0,0,0|1,0,0]=2 52 B10R0.75 CCCCCNC(=O)[C@H](C)O AIFCHEM-94552832270 [0,1,0,0,0,0|1,0,0]=2 53 B10R0.75 CCCCNCC(O)C(C)C AIFCHEM-94523035587 [0,1,0,0,0,0|1,0,2]=4 54 B10R0.83 CCCCCN(C)C(=O)CC AIFCHEM-94526505529 [0,1,0,0,0,0|1,0,0]=2 55 B10R0.83 CCCCNC(C)C(=O)NC AIFCHEM-94523037310 [0,1,0,0,0,0|2,0,0]=3 56 B10R0.83 CCCCN[C@@H](C)C(=O)NC AIFCHEM-94523039840 [0,1,0,0,0,0|2,0,0]=3 57 B10R0.83 CCCCN[C@H](C)C(=O)NC AIFCHEM-94523039844 [0,1,0,0,0,0|2,0,0]=3 58 B10R0.108 CCCC(C)NCC(F)CC AIFCHEM-94606111738 [0,1,0,0,0,0|2,0,1]=4 59 B10R0.108 CCN[C@@H](C)CCC(=O)OC AIFCHEM-94537416264 [0,1,0,0,0,0|2,0,0]=3 60 B10R0.108 COCC(C)NCC(=O)OC AIFCHEM-6212412316 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.1 CCCN1CCC(CC1)C AIFCHEM-94569020796 [0,0,0,1,0,0|2,0,1]=4 62 B10R1.1 CCCN1CCC(CC1)F AIFCHEM-94569020151 [0,0,0,1,0,0|2,0,1]=4 63 B10R1.1 CCCN1CCC(CC1)O AIFCHEM-94546652685 [0,0,0,1,0,0|1,0,2]=4 64 B10R1.15 O=C(CO)N1CCCOC1 AIFCHEM-94532677753 [0,0,0,1,0,0|3,0,0]=4 65 B10R1.16 CCCNC1CCN(C1)C AIFCHEM-94521371360 [0,0,0,1,0,0|3,0,0]=4 66 B10R1.16 CCCN[C@@H]1CCN(C1)C AIFCHEM-94538646650 [0,0,0,1,0,0|3,0,0]=4 67 B10R1.16 CCCN[C@H]1CCN(C1)C AIFCHEM-94569023430 [0,0,0,1,0,0|3,0,0]=4 68 B10R1.16 O=C1CC(CN1)NCCO AIFCHEM-6481479666 [0,0,0,1,0,0|3,0,0]=4 69 B10R1.27 CCC(=O)NC1CCCC1 AIFCHEM-94542387709 [0,0,0,1,0,0|1,0,0]=2 70 B10R1.56 CCCCNC[C@@H]1C[C@H]1C AIFCHEM-94523033944 [0,0,0,1,0,0|2,0,1]=4 71 B10R1.57 CCCCNCC1CCO1 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CCN1CCCC(CC1)F AIFCHEM-94537414919 [0,0,0,1,0,0|2,0,1]=4 86 B10R1.197 CCN1CCNC(=O)CC1 AIFCHEM-94537418113 [0,0,0,1,0,0|2,0,0]=3 87 B7R0.1 CCCCNCCC AIFCHEM-94569018116 [2,0,0,0,0,0|1,0,0]=3 88 B7R0.1 CCNCCSCC AIFCHEM-94537422686 [2,0,0,0,0,0|2,0,0]=4 89 B7R0.3 CCCNC(=O)CO AIFCHEM-94532683616 [2,0,0,0,0,0|2,0,0]=4 90 B7R0.3 CCNCC(=O)NC AIFCHEM-94562545297 [2,0,0,0,0,0|2,0,0]=4 91 B9R0.2 CCCCCNCC(C)C AIFCHEM-94563719037 [1,1,0,0,0,0|1,0,1]=4 92 B9R0.2 CCCNCCOC(C)C AIFCHEM-94569022755 [1,1,0,0,0,0|2,0,0]=4 93 B9R0.2 CCNCCCCN(C)C AIFCHEM-94537420638 [1,1,0,0,0,0|2,0,0]=4 94 B9R0.2 CCSCCNCC(C)C AIFCHEM-94572982023 [1,1,0,0,0,0|2,0,0]=4 95 B9R0.18 CCNC[C@H](C)CCCO AIFCHEM-94537418110 [1,1,0,0,0,0|2,0,0]=4 96 B9R0.45 CCCCCNCCCC AIFCHEM-94522650615 [1,1,0,0,0,0|0,0,1]=3 97 B9R0.45 CCNCCCOCCO AIFCHEM-94537427775 [1,1,0,0,0,0|2,0,0]=4 98 B9R0.45 CCNCCOCCOC AIFCHEM-94537420107 [1,1,0,0,0,0|2,0,0]=4 99 B9R0.1 CCC(=O)NCCC(C)C AIFCHEM-94526508254 [1,1,0,0,0,0|1,0,0]=3 100 B9R0.24 CCN(C)CCC(=O)NC 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CCOCCNC(=O)C[C@H](C)O AIFCHEM-94548616337 [0,2,0,0,0,0|2,0,0]=4 115 B11R0.2 COCCCNC(=O)CC(C)O AIFCHEM-5625946866 [0,2,0,0,0,0|2,0,0]=4 116 B11R0.2 COCCCNC(=O)C[C@@H](C)O AIFCHEM-94598899505 [0,2,0,0,0,0|2,0,0]=4 117 B11R0.2 COCCCNC(=O)C[C@H](C)O AIFCHEM-94598899444 [0,2,0,0,0,0|2,0,0]=4 118 B11R0.2 COCCOCC(=O)NC(C)C AIFCHEM-94520545546 [0,2,0,0,0,0|2,0,0]=4 119 B11R0.2 CSCCCNC(=O)CC(C)O AIFCHEM-94529061984 [0,2,0,0,0,0|2,0,0]=4 120 B11R0.2 CSCCCNC(=O)CC(F)F AIFCHEM-94529059495 [0,2,0,0,0,0|2,0,0]=4 121 B11R0.2 CSCCCNC(=O)C[C@@H](C)O AIFCHEM-94529064346 [0,2,0,0,0,0|2,0,0]=4 122 B11R0.2 CSCCCNC(=O)C[C@H](C)O AIFCHEM-94529064285 [0,2,0,0,0,0|2,0,0]=4 123 B11R0.4 C#CCC(=O)NCCCCCC AIFCHEM-94575442415 [0,2,0,0,0,0|0,0,1]=3 124 B11R0.4 C#CCC(=O)NCCCOCC AIFCHEM-6286531673 [0,2,0,0,0,0|1,0,1]=4 125 B11R0.4 C#CCCCCNC(=O)CCO AIFCHEM-6123800047 [0,2,0,0,0,0|0,0,2]=4 126 B11R0.4 CCCCCCNC(=O)CC#N AIFCHEM-94571773439 [0,2,0,0,0,0|0,0,1]=3 127 B11R0.4 CCCCCNCC(=O)NCC AIFCHEM-94551435148 [0,2,0,0,0,0|0,0,0]=2 128 B11R0.4 CCOCCCNC(=O)CC#N AIFCHEM-94559919680 [0,2,0,0,0,0|1,0,1]=4 129 B11R0.4 CCOCCCNC(=O)CCO AIFCHEM-6254100354 [0,2,0,0,0,0|1,0,0]=3 130 B11R0.4 CCOCCCNC(=O)CSC AIFCHEM-6274067116 [0,2,0,0,0,0|1,0,0]=3 131 B11R0.4 COCC(=O)NCCCCC#N AIFCHEM-5811456190 [0,2,0,0,0,0|1,0,1]=4 132 B11R0.5 CCCC[C@@H](C)NC(=O)CC#N AIFCHEM-94596960370 [0,2,0,0,0,0|1,0,1]=4 133 B11R0.62 CCCC(C)NCC(=O)NCC AIFCHEM-94606120356 [0,2,0,0,0,0|1,0,0]=3 134 B11R0.62 CCCN(C)CCC(=O)OCC AIFCHEM-94569015673 [0,2,0,0,0,0|1,0,0]=3 135 B11R0.62 CCNC(=O)CNC(C)COC AIFCHEM-5856080128 [0,2,0,0,0,0|2,0,0]=4 136 B11R0.81 C#CCCCCC(=O)NCCC AIFCHEM-5791168081 [0,2,0,0,0,0|0,0,2]=4 137 B11R0.81 C#CCNC(=O)COCCCC AIFCHEM-6216352144 [0,2,0,0,0,0|1,0,1]=4 138 B11R0.81 C/C=C/CC(=O)NCCCSC AIFCHEM-94529059662 [0,2,0,0,0,0|2,0,0]=4 139 B11R0.81 CCC#CC(=O)NCCOCC AIFCHEM-94548616193 [0,2,0,0,0,0|2,0,0]=4 140 B11R0.81 CCCCC(=O)NCCCSC AIFCHEM-94529057487 [0,2,0,0,0,0|2,0,0]=4 141 B11R0.81 CCCCC(=O)NCCSCC AIFCHEM-94534108919 [0,2,0,0,0,0|2,0,0]=4 142 B11R0.81 CCCCNCC(=O)NCCF AIFCHEM-94523033385 [0,2,0,0,0,0|1,0,0]=3 143 B11R0.81 CCCNC(=O)CCCCCO AIFCHEM-94521373241 [0,2,0,0,0,0|1,0,0]=3 144 B11R0.81 CCOCCNC(=O)COCC AIFCHEM-94548616409 [0,2,0,0,0,0|2,0,0]=4 145 B11R0.81 CCSCCNC(=O)CCC#N AIFCHEM-94566123322 [0,2,0,0,0,0|2,0,0]=4 146 B11R0.81 COCCCNC(=O)CCSC AIFCHEM-5645616034 [0,2,0,0,0,0|2,0,0]=4 147 B11R0.142 CCC(C)C(=O)NCCCOC AIFCHEM-94598892918 [0,2,0,0,0,0|2,0,0]=4 148 B11R0.142 CCCCCCC(C)N(C)CC AIFCHEM-6173130419 [0,2,0,0,0,0|1,0,1]=4 149 B11R0.142 CCCCCNC(=O)C(C)OC AIFCHEM-94522662424 [0,2,0,0,0,0|1,0,0]=3 150 B11R0.142 CCCCCNC(=O)C(O)CC AIFCHEM-94522663599 [0,2,0,0,0,0|1,0,0]=3 151 B11R0.142 CCCCCNC(=O)[C@@H](C)OC AIFCHEM-94522660778 [0,2,0,0,0,0|1,0,0]=3 152 B11R0.142 CCCCCNC(=O)[C@@H](O)CC AIFCHEM-94522661721 [0,2,0,0,0,0|1,0,0]=3 153 B11R0.142 CCCCCNC(=O)[C@H](C)OC AIFCHEM-94522660782 [0,2,0,0,0,0|1,0,0]=3 154 B11R0.142 CCCCCNC(=O)[C@H](O)CC AIFCHEM-94522660043 [0,2,0,0,0,0|1,0,0]=3 155 B11R0.142 CCOCCNC(=O)C(C)C#N AIFCHEM-94548616458 [0,2,0,0,0,0|2,0,0]=4 156 B11R0.142 CCOCCNC(=O)C(C)CC AIFCHEM-94548609811 [0,2,0,0,0,0|2,0,0]=4 157 B11R0.142 CCOCCNC(=O)C(O)CC AIFCHEM-94548616222 [0,2,0,0,0,0|2,0,0]=4 158 B11R0.142 CCOCCNC(=O)[C@@H](C)CC AIFCHEM-94548612000 [0,2,0,0,0,0|2,0,0]=4 159 B11R0.142 CCOCCNC(=O)[C@@H](O)CC AIFCHEM-94548614344 [0,2,0,0,0,0|2,0,0]=4 160 B11R0.142 CCOCCNC(=O)[C@H](C)CC AIFCHEM-94548614211 [0,2,0,0,0,0|2,0,0]=4 161 B11R0.142 CCOCCNC(=O)[C@H](O)CC AIFCHEM-94548612666 [0,2,0,0,0,0|2,0,0]=4 162 B11R0.142 CCSCCNC(=O)C(O)CC AIFCHEM-6012062429 [0,2,0,0,0,0|2,0,0]=4 163 B11R0.142 CCSCCNC(=O)[C@@H](O)CC AIFCHEM-94566125982 [0,2,0,0,0,0|2,0,0]=4 164 B11R0.142 CCSCCNC(=O)[C@H](O)CC AIFCHEM-94566124304 [0,2,0,0,0,0|2,0,0]=4 165 B11R0.142 CC[C@@H](C)C(=O)NCCCOC AIFCHEM-94598897318 [0,2,0,0,0,0|2,0,0]=4 166 B11R0.142 CC[C@H](C)C(=O)NCCCOC AIFCHEM-5592822700 [0,2,0,0,0,0|2,0,0]=4 167 B11R0.142 CNC(=O)C(C)NCCCSC AIFCHEM-94546182222 [0,2,0,0,0,0|2,0,0]=4 168 B11R0.142 CNC(=O)[C@@H](C)NCCCSC AIFCHEM-94546184756 [0,2,0,0,0,0|2,0,0]=4 169 B11R0.142 CNC(=O)[C@H](C)NCCCSC AIFCHEM-94546184752 [0,2,0,0,0,0|2,0,0]=4 170 B11R0.142 COCCCNC(=O)C(C)C#N AIFCHEM-5645172971 [0,2,0,0,0,0|2,0,0]=4 171 B11R0.155 C#CCC(=O)N(C)CCCCC AIFCHEM-6114883772 [0,2,0,0,0,0|1,0,1]=4 172 B11R0.155 CCCCCN(C)C(=O)CC#N AIFCHEM-94559916073 [0,2,0,0,0,0|1,0,1]=4 173 B11R0.155 CCCCCN(C)C(=O)COC AIFCHEM-6113309004 [0,2,0,0,0,0|1,0,0]=3 174 B11R0.155 CCCNCC(C)C(=O)OCC AIFCHEM-94521368687 [0,2,0,0,0,0|1,0,0]=3 175 B11R0.174 CCOC(=O)CCNC(C)CO AIFCHEM-6056632063 [0,2,0,0,0,0|2,0,0]=4 176 B11R0.174 COC(=O)CCCN(C)CCO AIFCHEM-94548502723 [0,2,0,0,0,0|2,0,0]=4 177 B11R0.176 CC(C)OCCNC(=O)CCO AIFCHEM-6282628800 [0,2,0,0,0,0|2,0,0]=4 178 B11R0.176 CCNC(=O)CNCCN(C)C AIFCHEM-94564768368 [0,2,0,0,0,0|2,0,0]=4 179 B11R0.110 CCC(C)CN(C)CC(=O)NC AIFCHEM-94608447479 [0,2,0,0,0,0|2,0,0]=4 180 B11R0.154 CCCCNC(C)CC(=O)NC AIFCHEM-94570971721 [0,2,0,0,0,0|1,0,0]=3 181 B11R0.154 CNC(=O)CC(C)NCCOC AIFCHEM-94602591984 [0,2,0,0,0,0|2,0,0]=4 182 B11R0.163 CCCC[C@@H](C)NC(=O)C(C)C AIFCHEM-94596963067 [0,2,0,0,0,0|1,0,0]=3 183 B11R0.246 CCCNC(C)(C)CC(=O)OC AIFCHEM-94569016949 [0,2,0,0,0,0|2,0,0]=4 184 B11R0.76 CCCCCCN(CC)C(=O)C AIFCHEM-99350844007 [0,2,0,0,0,0|1,0,0]=3 185 B11R0.76 CCCCCN[C@@H](CC)C(=O)N AIFCHEM-94590316492 [0,2,0,0,0,0|1,0,1]=4 186 B11R0.76 CCCCCN[C@H](CC)C(=O)N AIFCHEM-94551423183 [0,2,0,0,0,0|1,0,1]=4 187 B11R0.76 CCOCCCN(CC)C(=O)C AIFCHEM-99350442684 [0,2,0,0,0,0|2,0,0]=4 188 B11R0.124 CCCCCCNC(CC)CO AIFCHEM-94571765436 [0,2,0,0,0,0|0,0,2]=4 189 B11R0.124 CCCNCCCN(CC)CC AIFCHEM-94535242914 [0,2,0,0,0,0|2,0,0]=4 190 B11R0.200 CCC(CO)NCCC(=O)OC AIFCHEM-6108290124 [0,2,0,0,0,0|2,0,0]=4 191 B11R0.106 COC(=O)CCCNC(C)CF AIFCHEM-94592447638 [0,2,0,0,0,0|2,0,0]=4 192 B11R0.106 COC(=O)CCCN[C@@H](C)CF AIFCHEM-94592442353 [0,2,0,0,0,0|2,0,0]=4 193 B11R0.106 COC(=O)CCCN[C@H](C)CF AIFCHEM-94592440058 [0,2,0,0,0,0|2,0,0]=4 194 B11R0.106 COC(=O)CCNCC(O)CO AIFCHEM-6129774061 [0,2,0,0,0,0|2,0,0]=4 195 B11R0.106 COC(=O)CCNC[C@H](O)CO AIFCHEM-94590563084 [0,2,0,0,0,0|2,0,0]=4 196 B11R0.107 CNC(=O)CCN(C)CC(C)C AIFCHEM-94601213397 [0,2,0,0,0,0|2,0,0]=4 197 B11R0.109 COC(=O)CCCN(C)C(C)C AIFCHEM-94547936557 [0,2,0,0,0,0|2,0,0]=4 198 B11R0.114 CCC(=O)NCCOC(C)(C)C AIFCHEM-94526511395 [0,2,0,0,0,0|2,0,0]=4 199 B11R0.120 CCC(=O)CNC(=O)C(C)CC AIFCHEM-6095725644 [0,2,0,0,0,0|1,0,1]=4 200 B11R0.120 CCC(=O)CNC(=O)[C@H](C)CC AIFCHEM-6148943462 [0,2,0,0,0,0|1,0,1]=4 201 B11R0.320 CCC(=O)NCCC(C)(C)OC AIFCHEM-94526502545 [0,2,0,0,0,0|2,0,0]=4 202 B11R0.40 C#CCCCCCNC(=O)CO AIFCHEM-94532677738 [0,2,0,0,0,0|1,0,1]=4 203 B11R0.40 CNC(=O)CNCCCCCO AIFCHEM-94562543612 [0,2,0,0,0,0|1,0,0]=3 204 B11R0.40 COC(=O)CCCCNCC#N AIFCHEM-94558706736 [0,2,0,0,0,0|1,0,1]=4 205 B11R0.40 COC(=O)CCCNCCSC AIFCHEM-94592445028 [0,2,0,0,0,0|1,0,0]=3 206 B11R0.42 C#CCCCCNC(=O)C(C)O AIFCHEM-94537887317 [0,2,0,0,0,0|0,0,2]=4 207 B11R0.42 C#CCCCCNC(=O)[C@@H](C)O AIFCHEM-94537881047 [0,2,0,0,0,0|0,0,2]=4 208 B11R0.42 C#CCCCCNC(=O)[C@H](C)O AIFCHEM-6135135879 [0,2,0,0,0,0|0,0,2]=4 209 B11R0.42 CCCCCCNC(C)C(C)C AIFCHEM-94522500642 [0,2,0,0,0,0|1,0,1]=4 210 B11R0.42 CCOCCCNC(=O)C(C)O AIFCHEM-94571308352 [0,2,0,0,0,0|1,0,0]=3 211 B11R0.42 CCOCCCNC(=O)[C@@H](C)O AIFCHEM-6219660579 [0,2,0,0,0,0|1,0,0]=3 212 B11R0.42 CCOCCCNC(=O)[C@H](C)O AIFCHEM-6281382995 [0,2,0,0,0,0|1,0,0]=3 213 B11R0.70 CCCCC(C)NCC(F)CC AIFCHEM-94541393975 [0,2,0,0,0,0|1,0,1]=4 214 B11R0.70 CCCCN(C)CCC(=O)NC AIFCHEM-94523038530 [0,2,0,0,0,0|1,0,0]=3 215 B11R0.70 CCCNC(C)CCC(=O)OC AIFCHEM-5792700904 [0,2,0,0,0,0|1,0,0]=3 216 B11R0.70 CCCN[C@@H](C)CCC(=O)OC AIFCHEM-94569013347 [0,2,0,0,0,0|1,0,0]=3 217 B11R0.70 CCCOC(=O)CNC(=O)CC AIFCHEM-94602844204 [0,2,0,0,0,0|1,0,1]=4 218 B11R0.70 CCSCC(=O)NCC(=O)CC AIFCHEM-94580209890 [0,2,0,0,0,0|1,0,1]=4 219 B11R0.111 CCC(=O)NCCCCC(=O)N AIFCHEM-94526512387 [0,2,0,0,0,0|1,0,1]=4 220 B11R0.151 CCSCCNC(=O)C(C)(C)O AIFCHEM-94566127819 [0,2,0,0,0,0|2,0,0]=4 221 B11R0.151 COCCCNC(=O)C(C)(C)C AIFCHEM-5644961804 [0,2,0,0,0,0|2,0,0]=4 222 B11R0.151 CSCCCNC(=O)C(C)(C)C AIFCHEM-94529065071 [0,2,0,0,0,0|2,0,0]=4 223 B11R0.151 CSCCCNC(=O)C(C)(C)O AIFCHEM-94529064129 [0,2,0,0,0,0|2,0,0]=4 224 B11R0.75 CCC(=O)N(CC)CCCOC AIFCHEM-95157581664 [0,2,0,0,0,0|2,0,0]=4 225 B11R0.75 CCC(=O)N(CC)CCCSC AIFCHEM-95159740618 [0,2,0,0,0,0|2,0,0]=4 226 B11R0.75 CCCCCN(CC)C(=O)CC AIFCHEM-95157653016 [0,2,0,0,0,0|1,0,0]=3 227 B11R0.75 CCCCCN(CC)C(=O)CO AIFCHEM-100298369707 [0,2,0,0,0,0|2,0,0]=4 228 B11R0.75 CCCCNC(CO)C(=O)OC AIFCHEM-94523039215 [0,2,0,0,0,0|2,0,0]=4 229 B11R0.75 CCCCN[C@@H](CC)C(=O)OC AIFCHEM-94523039256 [0,2,0,0,0,0|2,0,0]=4 230 B11R0.75 CCCCN[C@@H](CO)C(=O)OC AIFCHEM-94523039295 [0,2,0,0,0,0|2,0,0]=4 231 B11R0.75 CCCCN[C@H](CC)C(=O)OC AIFCHEM-94523042374 [0,2,0,0,0,0|2,0,0]=4 232 B11R0.75 CCCCN[C@H](CO)C(=O)OC AIFCHEM-94523039554 [0,2,0,0,0,0|2,0,0]=4 233 B11R0.75 CCOCCN(CC)C(=O)CC AIFCHEM-95157836554 [0,2,0,0,0,0|2,0,0]=4 234 B11R0.75 CCSCCN(CC)C(=O)CC AIFCHEM-95157603770 [0,2,0,0,0,0|2,0,0]=4 235 B11R0.134 CCCN(CC)CCC(=O)NC AIFCHEM-94518723338 [0,2,0,0,0,0|2,0,0]=4 236 B9R1.8 CCNC1CCCCC1 AIFCHEM-94537419387 [1,0,0,1,0,0|1,0,0]=3 237 B9R1.14 CCC1CCCN1CC AIFCHEM-94537424244 [1,0,0,1,0,0|1,0,0]=3 238 B9R1.16 CCCNC[C@@H]1C[C@H]1C AIFCHEM-94599414203 [1,0,0,1,0,0|1,0,1]=4 239 B9R1.33 CCCN1CCCC1C AIFCHEM-94569019823 [1,0,0,1,0,0|1,0,1]=4 240 B9R1.33 CCCN1CCC[C@@H]1C AIFCHEM-94569013885 [1,0,0,1,0,0|1,0,1]=4 241 B9R1.33 CCCN1CCC[C@H]1C AIFCHEM-94548508901 [1,0,0,1,0,0|1,0,1]=4 242 B9R1.79 CCC(=O)NC1CSC1 AIFCHEM-94526501439 [1,0,0,1,0,0|2,0,0]=4 243 B9R1.96 CCN1CC[C@H]1C(=O)N AIFCHEM-94567088427 [1,0,0,1,0,0|2,0,0]=4 244 B11R1.16 CCCN(C)C1CCCCC1 AIFCHEM-94569008239 [0,1,0,1,0,0|2,0,0]=4 245 B11R1.16 CN(CCO)C1CCCCC1 AIFCHEM-94548501713 [0,1,0,1,0,0|2,0,0]=4 246 B11R1.16 O=C(CCO)N1CCSCC1 AIFCHEM-94541234957 [0,1,0,1,0,0|2,0,0]=4 247 B11R1.24 CCCNC1CCNC(=O)C1 AIFCHEM-94569013012 [0,1,0,1,0,0|1,0,0]=3 248 B11R1.30 COCC(=O)NC1CCCC1 AIFCHEM-94542386780 [0,1,0,1,0,0|1,0,0]=3 249 B11R1.117 CCCN1CCCCCCC1 AIFCHEM-94569009342 [0,1,0,1,0,0|2,0,0]=4 250 B11R1.135 CCCN1CCNC(=O)CC1 AIFCHEM-94569015196 [0,1,0,1,0,0|1,0,0]=3 251 B11R1.180 CCCCNC1CONC1=O AIFCHEM-94523040664 [0,1,0,1,0,0|2,0,0]=4 252 B11R1.180 CCCCN[C@@H]1CONC1=O AIFCHEM-94523040665 [0,1,0,1,0,0|2,0,0]=4 253 B11R1.180 CCCCN[C@H]1CONC1=O AIFCHEM-94523036733 [0,1,0,1,0,0|2,0,0]=4 254 B11R1.199 COCC(=O)N1CCCC1C AIFCHEM-94592646211 [0,1,0,1,0,0|1,0,0]=3 255 B11R1.199 COCC(=O)N1CCC[C@@H]1C AIFCHEM-5634102355 [0,1,0,1,0,0|1,0,0]=3 256 B11R1.199 COCC(=O)N1CCC[C@H]1C AIFCHEM-94548522062 [0,1,0,1,0,0|1,0,0]=3 257 B11R1.199 CSCC(=O)N1CCSC1C AIFCHEM-94597275952 [0,1,0,1,0,0|2,0,0]=4 258 B11R1.289 CCOC(=O)CNC1CCC1 AIFCHEM-94576055917 [0,1,0,1,0,0|1,0,0]=3 259 B11R1.289 CSCC(=O)NCC1COC1 AIFCHEM-5949568959 [0,1,0,1,0,0|2,0,0]=4 260 B11R1.290 CCOC(=O)CNCC1CC1 AIFCHEM-5643711363 [0,1,0,1,0,0|1,0,0]=3 261 B11R1.356 CCOCCNC(=O)C1CC1 AIFCHEM-94548612064 [0,1,0,1,0,0|2,0,0]=4 262 B11R1.39 CCC(=O)NC1CCN(C1)C AIFCHEM-94526500605 [0,1,0,1,0,0|2,0,0]=4 263 B11R1.39 CCC(=O)N[C@@H]1CCN(C1)C AIFCHEM-94526507593 [0,1,0,1,0,0|2,0,0]=4 264 B11R1.39 CCC(=O)N[C@H]1CCN(C1)C AIFCHEM-94526511216 [0,1,0,1,0,0|2,0,0]=4 265 B11R1.40 O=C(CO)NC1CCCOC1 AIFCHEM-94532684792 [0,1,0,1,0,0|2,0,0]=4 266 B11R1.40 O=C(CO)N[C@@H]1CCCOC1 AIFCHEM-94532676794 [0,1,0,1,0,0|2,0,0]=4 267 B11R1.40 O=C(CO)N[C@H]1CCCOC1 AIFCHEM-6136630525 [0,1,0,1,0,0|2,0,0]=4 268 B11R1.198 CNC(=O)CN(C)CC1CC1 AIFCHEM-94608442451 [0,1,0,1,0,0|2,0,0]=4 269 B11R1.231 CCNCC1CC(=O)N(C1)C AIFCHEM-94537427268 [0,1,0,1,0,0|2,0,0]=4 270 B11R1.264 CCC(=O)NC1CC(C1)OC AIFCHEM-94526502202 [0,1,0,1,0,0|2,0,0]=4 271 B11R1.264 CCC(=O)N[C@H]1C[C@@H](C1)OC AIFCHEM-94526502222 [0,1,0,1,0,0|2,0,0]=4 272 B11R1.264 CCC(=O)N[C@H]1C[C@H](C1)OC AIFCHEM-94526502223 [0,1,0,1,0,0|2,0,0]=4 273 B11R1.12 CCN(CC)C1CCCCC1 AIFCHEM-94537422727 [0,1,0,1,0,0|2,0,0]=4 274 B11R1.83 CCCC1CCN(CC1)CC AIFCHEM-94537421794 [0,1,0,1,0,0|2,0,0]=4 275 B11R1.83 CCCN1CCN(CC1)N=O AIFCHEM-94535495495 [0,1,0,1,0,0|2,0,0]=4 276 B11R1.20 CC(C)CN1CCS(=O)CC1 AIFCHEM-94572984528 [0,1,0,1,0,0|2,0,0]=4 277 B11R1.23 CCC(=O)N1CCCC(=O)C1 AIFCHEM-94526505866 [0,1,0,1,0,0|1,0,1]=4 278 B11R1.224 CCC(=O)NCC1CC(=O)C1 AIFCHEM-94526502280 [0,1,0,1,0,0|1,0,1]=4 279 B11R1.224 CNC(=O)CNC1CC(C1)O AIFCHEM-94562541429 [0,1,0,1,0,0|2,0,0]=4 280 B11R1.237 CCC(C)CNCCC1CC1 AIFCHEM-5697343846 [0,1,0,1,0,0|1,0,1]=4 281 B11R1.237 COC(=O)CCCNC1CC1 AIFCHEM-94592437840 [0,1,0,1,0,0|1,0,0]=3 282 B11R1.237 COC(=O)CCNCC1CC1 AIFCHEM-6173958767 [0,1,0,1,0,0|1,0,0]=3 283 B11R1.22 CCC(=O)N1CCC(CC1)F AIFCHEM-94526508591 [0,1,0,1,0,0|1,0,0]=3 284 B11R1.44 CCN1CCC(C1)C(=O)OC AIFCHEM-94537427737 [0,1,0,1,0,0|2,0,0]=4 285 B11R1.44 CCN1CC[C@@H](C1)C(=O)OC AIFCHEM-94537412133 [0,1,0,1,0,0|2,0,0]=4 286 B11R1.44 CCN1CC[C@H](C1)C(=O)OC AIFCHEM-94592524217 [0,1,0,1,0,0|2,0,0]=4 287 B11R1.236 COC(=O)CNCC1CCC1 AIFCHEM-6212836390 [0,1,0,1,0,0|1,0,0]=3 288 B11R1.82 CCNC1CCS(=O)(=O)CC1 AIFCHEM-94537418226 [0,1,0,1,0,0|2,0,0]=4 289 B11R1.1 CCCCN1CCC(CC1)C AIFCHEM-94523040026 [0,1,0,1,0,0|1,0,1]=4 290 B11R1.1 CCCNC1CCS(=O)CC1 AIFCHEM-94521367617 [0,1,0,1,0,0|1,0,0]=3 291 B11R1.13 CCCN1CCNC(=O)C1C AIFCHEM-94569016072 [0,1,0,1,0,0|1,0,0]=3 292 B11R1.13 CCCN1CCNC(=O)[C@@H]1C AIFCHEM-94569022530 [0,1,0,1,0,0|1,0,0]=3 293 B11R1.13 CCCN1CCNC(=O)[C@H]1C AIFCHEM-94569024217 [0,1,0,1,0,0|1,0,0]=3 294 B11R1.25 C#CC(=O)NCC1CCCC1 AIFCHEM-94573925864 [0,1,0,1,0,0|0,0,2]=4 295 B11R1.25 CCC(F)CNC1CCCC1 AIFCHEM-94541520734 [0,1,0,1,0,0|1,0,1]=4 296 B11R1.25 O=C(CO)NCC1CCCC1 AIFCHEM-94532683931 [0,1,0,1,0,0|1,0,0]=3 297 B11R1.25 O=C(CO)NC[C@@H]1CCCO1 AIFCHEM-94532680107 [0,1,0,1,0,0|2,0,0]=4 298 B11R1.25 O=C(CO)NC[C@H]1CCCO1 AIFCHEM-94552583621 [0,1,0,1,0,0|2,0,0]=4 299 B11R1.27 CCCCNC1CNC(=O)C1 AIFCHEM-94570972996 [0,1,0,1,0,0|1,0,0]=3 300 B11R1.27 CCCCN[C@H]1CNC(=O)C1 AIFCHEM-94523033306 [0,1,0,1,0,0|1,0,0]=3 301 B11R1.27 CCCNCC1CCC(=O)N1 AIFCHEM-94569009564 [0,1,0,1,0,0|1,0,0]=3 302 B11R1.27 CCCNC[C@@H]1CCC(=O)N1 AIFCHEM-94569015803 [0,1,0,1,0,0|1,0,0]=3 303 B11R1.27 CCCNC[C@H]1CCC(=O)N1 AIFCHEM-94569013841 [0,1,0,1,0,0|1,0,0]=3 304 B11R1.27 O=C1CC(CN1)NCCCO AIFCHEM-6421329747 [0,1,0,1,0,0|2,0,0]=4 305 B11R1.47 CCCCCCCN1CCC1 AIFCHEM-94604918926 [0,1,0,1,0,0|2,0,0]=4 306 B11R1.59 O=C(CO)N1CCC[C@H]1CF AIFCHEM-94532685697 [0,1,0,1,0,0|2,0,0]=4 307 B11R1.115 CCCN1CCC1C(=O)OC AIFCHEM-94569013447 [0,1,0,1,0,0|1,0,0]=3 308 B11R1.35 CC(C)C(=O)NC1CCOC1 AIFCHEM-94559763596 [0,1,0,1,0,0|2,0,0]=4 309 B11R1.35 CC(C)C(=O)N[C@@H]1CCOC1 AIFCHEM-94545041272 [0,1,0,1,0,0|2,0,0]=4 310 B11R1.35 CC(C)C(=O)N[C@H]1CCOC1 AIFCHEM-94585480798 [0,1,0,1,0,0|2,0,0]=4 311 B11R1.36 CC(C)C(=O)N1CCCOC1 AIFCHEM-94545044086 [0,1,0,1,0,0|2,0,0]=4 312 B11R1.36 CC(C)C(=O)N1CCSCC1 AIFCHEM-94545042477 [0,1,0,1,0,0|2,0,0]=4 313 B11R1.89 CC(O)C(=O)N1CCSC1C AIFCHEM-94540229968 [0,1,0,1,0,0|2,0,0]=4 314 B11R1.89 CC1SCCN1C(=O)[C@@H](C)O AIFCHEM-94597271784 [0,1,0,1,0,0|2,0,0]=4 315 B11R1.89 CC1SCCN1C(=O)[C@H](C)O AIFCHEM-94597279808 [0,1,0,1,0,0|2,0,0]=4 316 B11R1.104 CC(O)C(=O)NC[C@@H]1C[C@H]1C AIFCHEM-94540228844 [0,1,0,1,0,0|1,0,0]=3 317 B11R1.104 C[C@@H]1C[C@H]1CNC(=O)[C@@H](C)O AIFCHEM-94599420272 [0,1,0,1,0,0|1,0,0]=3 318 B11R1.104 C[C@H](O)C(=O)NC[C@@H]1C[C@H]1C AIFCHEM-94599428296 [0,1,0,1,0,0|1,0,0]=3 319 B11R1.332 CC(C)C(=O)NCC1CCO1 AIFCHEM-94545053650 [0,1,0,1,0,0|2,0,0]=4 320 B11R1.332 CC(C)C(=O)NC[C@@H]1CCO1 AIFCHEM-94545046166 [0,1,0,1,0,0|2,0,0]=4 321 B11R1.332 CC(C)C(=O)NC[C@H]1CCO1 AIFCHEM-94545046162 [0,1,0,1,0,0|2,0,0]=4 322 B11R1.332 CC(O)C(=O)NCC1CCC1 AIFCHEM-94571307517 [0,1,0,1,0,0|1,0,0]=3 323 B11R1.332 C[C@@H](O)C(=O)NCC1CCC1 AIFCHEM-5699645317 [0,1,0,1,0,0|1,0,0]=3 324 B11R1.332 C[C@H](O)C(=O)NCC1CCC1 AIFCHEM-5727642111 [0,1,0,1,0,0|1,0,0]=3 325 B11R1.333 CN(C)C(=O)CNCC1CC1 AIFCHEM-5653039172 [0,1,0,1,0,0|2,0,0]=4 326 B11R1.958 CCN1CCC(=O)N(CC1)C AIFCHEM-94540558675 [0,1,0,1,0,0|2,0,0]=4 327 B11R1.859 CCC(=O)NCC1(CCC1)C AIFCHEM-94526501062 [0,1,0,1,0,0|1,0,0]=3 328 B11R1.859 CCC(=O)NCC1(COC1)C AIFCHEM-94526502829 [0,1,0,1,0,0|2,0,0]=4 329 B11R2.239 C1CCC(CC1)N2CCC2 AIFCHEM-94601793039 [0,0,0,2,0,0|2,0,0]=4 330 B11R2.351 O=C1CC(CO1)NC2CC2 AIFCHEM-94573316446 [0,0,0,2,0,0|2,0,0]=4 331 B11R2.352 O=C1CC(CN1)N2CCC2 AIFCHEM-94604922161 [0,0,0,2,0,0|2,0,0]=4 332 B11R2.352 O=C1CC(CO1)N2CCC2 AIFCHEM-94604922678 [0,0,0,2,0,0|2,0,0]=4 333 B11R2.985 CCN1CC2(C1)CCCC2 AIFCHEM-94537424214 [0,0,0,2,0,0|2,0,0]=4 334 B11R2.1009 CCN1CCC2(C1)CCC2 AIFCHEM-94537425219 [0,0,0,2,0,0|2,0,0]=4 335 B11R2.898 O=C(CO)N1CC2CC1C2 AIFCHEM-5769991921 [0,0,0,2,0,0|2,0,0]=4