0 B9R0.46 CCCCCC[C@@H](C)CC T72672 [0,0,0,0,0,0|1,0,1]=2 1 B9R0.46 CCCCCC[C@H](O)CO C16570 [0,0,0,0,0,0|1,0,2]=3 2 B9R0.46 CCOCCNC(=O)CCl A50975 [0,0,0,0,0,0|3,0,0]=3 3 B9R0.46 CC[C@H](C)CCCCCO T71591 [0,0,0,0,0,0|2,0,1]=3 4 B9R0.46 COC(=O)COCCCO 56926 [0,0,0,0,0,0|3,0,0]=3 5 B9R0.46 COCCCCC(=O)OC AC9127 [0,0,0,0,0,0|2,0,0]=2 6 B9R0.46 OCCCCC[C@H](O)CO T72391 [0,0,0,0,0,0|2,0,2]=4 7 B8R0.4 CCC#CCCCCC T72039 [1,0,0,0,0,0|0,0,2]=3 8 B8R0.4 CNCCCCCCO AT11159 [1,0,0,0,0,0|2,0,1]=4 9 B8R0.4 ClCCCCCCCCl T71360 [1,0,0,0,0,0|2,0,1]=4 10 B8R0.4 NCCCCCCCO AT22494 [1,0,0,0,0,0|2,0,1]=4 11 B8R0.6 CC[C@H](C)CCCCO T72651 [1,0,0,0,0,0|2,0,1]=4 12 B8R0.6 CNC(=O)OCCCN AT13711 [1,0,0,0,0,0|3,0,0]=4 13 B8R0.6 COC(=O)NCCCN AT13710 [1,0,0,0,0,0|3,0,0]=4 14 B8R0.7 CC(=O)NCCCCN S12336 [1,0,0,0,0,0|2,0,0]=3 15 B8R0.7 CCCCC#CC(=O)O T71801 [1,0,0,0,0,0|1,0,2]=4 16 B8R0.7 CCCCNCC(=O)O D87235 [1,0,0,0,0,0|2,0,0]=3 17 B8R0.7 CNCCCCN(C)C F51688 [1,0,0,0,0,0|3,0,0]=4 18 B8R0.7 CNCCCNC(C)=O C78307 [1,0,0,0,0,0|2,0,0]=3 19 B8R0.7 NC(=O)CCCCCO AC6170 [1,0,0,0,0,0|2,0,0]=3 20 B8R0.7 O=C(O)CCOCCBr C70446 [1,0,0,0,0,0|3,0,0]=4 21 B8R0.7 O=C(O)CCOCCO C70447 [1,0,0,0,0,0|3,0,0]=4 22 B8R0.7 [2H][C@H](Br)CCCCCC D99523 [1,0,0,0,0,0|2,0,1]=4 23 B8R0.7 [2H][C@H](O)CCCCCC D99646 [1,0,0,0,0,0|1,0,2]=4 24 B10R0.1 CCOC(=O)CCCCCN 77390 [0,1,0,0,0,0|1,0,0]=2 25 B10R0.1 CCOC(=O)COCCCO S11911 [0,1,0,0,0,0|2,0,0]=3 26 B10R0.41 CCN(CC)CCCCCBr AC5247 [0,1,0,0,0,0|3,0,0]=4 27 B10R0.41 CCN(CC)CCCCCCl AC7200 [0,1,0,0,0,0|3,0,0]=4 28 B10R0.74 CCCCCCC[C@H](O)CO T72466 [0,1,0,0,0,0|1,0,2]=4 29 B10R0.74 COC(=O)CCCCCC=O A51072 [0,1,0,0,0,0|1,0,1]=3 30 B10R0.74 COC(=O)CCCCCCN F19219 [0,1,0,0,0,0|1,0,0]=2 31 B10R0.74 OCCCCCC[C@H](O)CO T72401 [0,1,0,0,0,0|1,0,2]=4 32 B10R0.75 C#CCCCCC(=O)N(C)C F12473 [0,1,0,0,0,0|1,0,2]=4 33 B10R0.83 COC(=O)[C@@H](N)CCCCN S11847 [0,1,0,0,0,0|2,0,0]=3 34 B10R1.1 CCCC1CCC(N)CC1 T71534 [0,0,0,1,0,0|1,0,1]=3 35 B10R1.1 NCCC1CCC(N)CC1 D88527 [0,0,0,1,0,0|2,0,1]=4 36 B10R1.1 NCCN1CCC(=O)CC1 D88106 [0,0,0,1,0,0|2,0,0]=3 37 B10R1.1 NCCN1CCS(=O)CC1 AT25295 [0,0,0,1,0,0|3,0,0]=4 38 B10R1.2 CN1C(=O)CCC[C@@H]1CO P13154 [0,0,0,1,0,0|2,0,0]=3 39 B10R1.15 CC[C@H](N)C1CCOCC1 53163 [0,0,0,1,0,0|2,0,1]=4 40 B10R1.15 CC[C@H](O)C1CCOCC1 AC9165 [0,0,0,1,0,0|1,0,2]=4 41 B10R1.15 CNC(=O)N1CCNCC1 AT22986 [0,0,0,1,0,0|3,0,0]=4 42 B10R1.15 CNC(=O)[C@@H]1CCCCN1 C77819 [0,0,0,1,0,0|2,0,0]=3 43 B10R1.15 CNC(=O)[C@@H]1CCCCN1 C78037 [0,0,0,1,0,0|2,0,0]=3 44 B10R1.15 CNC(=O)[C@@H]1CCCCN1 C78113 [0,0,0,1,0,0|2,0,0]=3 45 B10R1.15 CNC(=O)[C@H]1CCCNC1 AC6269 [0,0,0,1,0,0|2,0,0]=3 46 B10R1.15 COC(=O)[C@@H]1CNCCN1 64289 [0,0,0,1,0,0|3,0,0]=4 47 B10R1.15 COC(=O)[C@@H]1CNCCN1 F16118 [0,0,0,1,0,0|3,0,0]=4 48 B10R1.15 COC(=O)[C@@H]1CNCCO1 F19021 [0,0,0,1,0,0|3,0,0]=4 49 B10R1.15 COC(=O)[C@@H]1CNCCO1 F19022 [0,0,0,1,0,0|3,0,0]=4 50 B10R1.15 COC(=O)[C@@H]1COCCN1 D76308 [0,0,0,1,0,0|3,0,0]=4 51 B10R1.15 N=C(NO)C1CCCCC1 91925 [0,0,0,1,0,0|3,0,0]=4 52 B10R1.15 NCC(=O)C1CCCCC1 P14033 [0,0,0,1,0,0|1,0,0]=2 53 B10R1.15 NCC(=O)N1CCOCC1 C78088 [0,0,0,1,0,0|3,0,0]=4 54 B10R1.15 N[C@@H](CO)C1CCCCC1 N11205 [0,0,0,1,0,0|2,0,1]=4 55 B10R1.15 O=C(CO)N1CCNCC1 AT23104 [0,0,0,1,0,0|3,0,0]=4 56 B10R1.27 CN[C@@H](C)CC1CCCC1 D84278 [0,0,0,1,0,0|2,0,1]=4 57 B10R1.27 COC(=O)C[C@H]1CCCN1 D78493 [0,0,0,1,0,0|2,0,0]=3 58 B10R1.27 COC(=O)C[C@H]1CCCO1 F52226 [0,0,0,1,0,0|2,0,0]=3 59 B10R1.27 COC(=O)C[C@H]1CCOC1 D76458 [0,0,0,1,0,0|2,0,0]=3 60 B10R1.96 CCN1CC[C@H](CCN)C1 F50257 [0,0,0,1,0,0|3,0,0]=4 61 B10R1.96 CCN1CC[C@H](CCN)C1 F50333 [0,0,0,1,0,0|3,0,0]=4 62 B10R1.149 CCC(=O)C1NCCC1O S10053 [0,0,0,1,0,0|2,0,0]=3 63 B10R1.149 COC(=O)C1NCCC1O F51597 [0,0,0,1,0,0|3,0,0]=4 64 B10R1.149 COC(=O)[C@@H]1CCCN1C C74446 [0,0,0,1,0,0|2,0,0]=3 65 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N 98154 [0,0,0,1,0,0|2,0,0]=3 66 B10R1.149 COC(=O)[C@H]1COC[C@@H]1N D79669 [0,0,0,1,0,0|3,0,0]=4 67 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O P11675 [0,0,0,1,0,0|3,0,0]=4 68 B10R1.151 COC(=O)\C=C\C1CCC1 W11680 [0,0,0,1,0,0|1,0,2]=4 69 B10R1.157 COC(=O)CC1CC1CN D79180 [0,0,0,1,0,0|2,0,0]=3 70 B10R1.161 CNC1CCCCCCC1 L10188 [0,0,0,1,0,0|2,0,1]=4 71 B10R1.175 C#CC1CCC1C(=O)OC 58314 [0,0,0,1,0,0|1,0,2]=4 72 B7R0.1 C=CCCCCCCl I11994 [2,0,0,0,0,0|1,0,1]=4 73 B7R0.1 C=CCCCCCO F14745 [2,0,0,0,0,0|1,0,1]=4 74 B7R0.1 CNCCCCCO AT11157 [2,0,0,0,0,0|2,0,0]=4 75 B7R0.1 CNCCCCCO AT11158 [2,0,0,0,0,0|2,0,0]=4 76 B7R0.1 C\C=C/CCCCC T72919 [2,0,0,0,0,0|0,0,1]=3 77 B7R0.1 O=CCCCCCCl 24359 [2,0,0,0,0,0|1,0,0]=3 78 B7R0.1 OCCCCCCI AT14272 [2,0,0,0,0,0|2,0,0]=4 79 B7R0.3 CCC(=O)OCOC D72002 [2,0,0,0,0,0|2,0,0]=4 80 B7R0.3 CCCNC(=O)CN C78397 [2,0,0,0,0,0|2,0,0]=4 81 B7R0.3 COC(=O)CCCN 32601 [2,0,0,0,0,0|2,0,0]=4 82 B7R0.4 CC(=O)NCCCN AR2174 [2,0,0,0,0,0|2,0,0]=4 83 B7R0.4 CCCCCC(N)=S W19000 [2,0,0,0,0,0|1,1,0]=4 84 B7R0.4 CCNCCC(N)=O A11725 [2,0,0,0,0,0|2,0,0]=4 85 B7R0.4 CNCCCC(N)=O AB11605 [2,0,0,0,0,0|2,0,0]=4 86 B7R0.4 CNCCNC(C)=O C77870 [2,0,0,0,0,0|2,0,0]=4 87 B7R0.4 C[S@](=O)CCCCN 13216 [2,0,0,0,0,0|2,0,0]=4 88 B7R0.4 NC(=O)CCCCBr AC9465 [2,0,0,0,0,0|2,0,0]=4 89 B7R0.4 NC(=O)CCCCCl AC5718 [2,0,0,0,0,0|2,0,0]=4 90 B7R0.4 NCCCCC(N)=O AC3685 [2,0,0,0,0,0|2,0,0]=4 91 B9R0.2 CC(C)CCCCCCO D98911 [1,1,0,0,0,0|1,0,1]=4 92 B9R0.18 CCCCC(C)CCCC T71863 [1,1,0,0,0,0|0,0,1]=3 93 B9R0.45 C=CCCCCCCCC T73018 [1,1,0,0,0,0|0,0,2]=4 94 B9R0.45 CC#CCCCCCCC H11435 [1,1,0,0,0,0|0,0,2]=4 95 B9R0.45 C\C=C/CCCCCCC T70533 [1,1,0,0,0,0|0,0,1]=3 96 B9R0.1 CC[C@H](C)CCCC(C)C T70540 [1,1,0,0,0,0|1,0,1]=4 97 B9R0.34 CCCC(C)CC(C)CC T70352 [1,1,0,0,0,0|1,0,1]=4 98 B9R0.34 CCC[C@H](N)CC(=O)OC N15477 [1,1,0,0,0,0|1,0,0]=3 99 B9R0.47 CCCCCC(=O)C(=O)O A11260 [1,1,0,0,0,0|1,0,1]=4 100 B9R0.47 CCCCOC(=O)C(O)O F17058 [1,1,0,0,0,0|2,0,0]=4 101 B9R0.47 CCCCOC(=O)[C@H](C)N F52316 [1,1,0,0,0,0|1,0,0]=3 102 B9R0.50 CCN(CCCCO)N=O T72602 [1,1,0,0,0,0|2,0,0]=4 103 B9R0.4 CCCC[C@H](N)CC(=O)O N14199 [1,1,0,0,0,0|1,0,0]=3 104 B9R0.4 CCCC[C@H](N)CC(=O)O N14200 [1,1,0,0,0,0|1,0,0]=3 105 B9R0.38 CS(=O)(=O)CCCCCN AT13638 [1,1,0,0,0,0|2,0,0]=4 106 B11R0.4 CCC\C=C\CCC(=O)OCC E70248 [0,2,0,0,0,0|0,0,1]=3 107 B11R0.4 CCOC(=O)COCCCCO AT19862 [0,2,0,0,0,0|1,0,0]=3 108 B11R0.176 CCOC(=O)CCCCC(=O)Cl S10472 [0,2,0,0,0,0|1,0,1]=4 109 B11R0.176 CCOC(=O)CCCCN(C)C AC6409 [0,2,0,0,0,0|1,0,0]=3 110 B11R0.154 CCCCCC(=O)CC(=O)OC A11017 [0,2,0,0,0,0|1,0,0]=3 111 B11R0.326 COC(=O)C(C)(C)CCCCBr AT10080 [0,2,0,0,0,0|2,0,0]=4 112 B9R1.8 CCCC1CCNCC1 C75224 [1,0,0,1,0,0|1,0,0]=3 113 B9R1.8 CCC[C@H]1CCCCN1 F16887 [1,0,0,1,0,0|1,0,1]=4 114 B9R1.8 CCNC1CCNCC1 AC8313 [1,0,0,1,0,0|2,0,0]=4 115 B9R1.8 CNCC1CCCCC1 P19116 [1,0,0,1,0,0|1,0,1]=4 116 B9R1.8 CNCC1CCOCC1 71672 [1,0,0,1,0,0|2,0,0]=4 117 B9R1.8 NCCC1CCNCC1 65278 [1,0,0,1,0,0|2,0,0]=4 118 B9R1.12 CCCC[C@H]1CCCN1 N12661 [1,0,0,1,0,0|1,0,1]=4 119 B9R1.12 CNCCC1CCCC1 P11107 [1,0,0,1,0,0|1,0,1]=4 120 B9R1.12 NCCCC1CCCC1 F20043 [1,0,0,1,0,0|1,0,1]=4 121 B9R1.15 CCC1CCCCC1C T72380 [1,0,0,1,0,0|0,0,1]=3 122 B9R1.15 CCC1CCCCC1O D90497 [1,0,0,1,0,0|1,0,1]=4 123 B9R1.89 OC[C@H]1CCCNCC1 73020 [1,0,0,1,0,0|2,0,0]=4 124 B9R1.1 CC[C@H]1CC[C@H](N)CC1 AT14260 [1,0,0,1,0,0|1,0,1]=4 125 B9R1.1 CC[C@H]1CNC(=O)CO1 90060 [1,0,0,1,0,0|2,0,0]=4 126 B9R1.1 CNC1CCC(=O)CC1 AB9600 [1,0,0,1,0,0|1,0,0]=3 127 B9R1.1 O=C1CCC(CBr)CC1 C77512 [1,0,0,1,0,0|1,0,0]=3 128 B9R1.3 CC1CCCC(C)C1C T71900 [1,0,0,1,0,0|1,0,1]=4 129 B9R1.7 CNC[C@H]1CCC(=O)N1 AT13580 [1,0,0,1,0,0|2,0,0]=4 130 B9R1.7 O=C1CC[C@H](CCO)N1 AT10892 [1,0,0,1,0,0|2,0,0]=4 131 B9R1.11 C#CC(=O)C1CCCC1 88682 [1,0,0,1,0,0|0,0,2]=4 132 B9R1.11 CCC(=O)C1CCCC1 F53464 [1,0,0,1,0,0|0,0,0]=2 133 B9R1.11 CC[C@H](N)C1CCCC1 N12792 [1,0,0,1,0,0|1,0,1]=4 134 B9R1.11 CC[C@H](N)C1CCCC1 N14676 [1,0,0,1,0,0|1,0,1]=4 135 B9R1.11 CC[C@H](N)C1CCCC1 N14677 [1,0,0,1,0,0|1,0,1]=4 136 B9R1.11 CNC(=O)[C@@H]1CCCN1 C78390 [1,0,0,1,0,0|2,0,0]=4 137 B9R1.11 CNC(=O)[C@@H]1CCCN1 C78509 [1,0,0,1,0,0|2,0,0]=4 138 B9R1.11 CNC(=O)[C@H]1CCNC1 AT18760 [1,0,0,1,0,0|2,0,0]=4 139 B9R1.11 CNC(=O)[C@H]1CCNC1 AT18761 [1,0,0,1,0,0|2,0,0]=4 140 B9R1.11 COC(=O)[C@H]1CCNC1 C15796 [1,0,0,1,0,0|2,0,0]=4 141 B9R1.11 O=C(CBr)N1CCCC1 T71443 [1,0,0,1,0,0|2,0,0]=4 142 B9R1.79 CNC(=O)C[C@H]1CCN1 F50337 [1,0,0,1,0,0|2,0,0]=4 143 B9R1.79 NCC(=O)NC1CCC1 98117 [1,0,0,1,0,0|2,0,0]=4 144 B9R1.81 COC(=O)C1CCC1N P20420 [1,0,0,1,0,0|2,0,0]=4 145 B9R1.81 COC(=O)[C@H]1CC[C@@H]1N AT10518 [1,0,0,1,0,0|2,0,0]=4 146 B9R1.88 COC(=O)C1CC1CO D73969 [1,0,0,1,0,0|2,0,0]=4 147 B9R1.6 CC(=O)[C@@H]1CCCCN1 F16683 [1,0,0,1,0,0|1,0,0]=3 148 B9R1.6 CC(=O)[C@H]1CCCNC1 P11325 [1,0,0,1,0,0|1,0,0]=3 149 B9R1.6 CC(=O)[C@H]1CCCOC1 AT13308 [1,0,0,1,0,0|1,0,0]=3 150 B9R1.6 C[C@H](Br)C1CCCCC1 O10008 [1,0,0,1,0,0|1,0,1]=4 151 B9R1.6 C[C@H](N)C1CCCCC1 79907 [1,0,0,1,0,0|1,0,1]=4 152 B9R1.6 C[C@H](N)C1CCCCC1 79908 [1,0,0,1,0,0|1,0,1]=4 153 B9R1.6 C[C@H](O)C1CCCCC1 D77196 [1,0,0,1,0,0|0,0,2]=4 154 B9R1.6 NC(=O)[C@@H]1CCCCN1 CS3415 [1,0,0,1,0,0|2,0,0]=4 155 B9R1.6 O=C(O)[C@@H]1CCCCS1 90959 [1,0,0,1,0,0|2,0,0]=4 156 B9R1.13 CC(=O)C=C1CCCC1 F13249 [1,0,0,1,0,0|0,0,2]=4 157 B9R1.13 CC(=O)CC1CCCC1 N12760 [1,0,0,1,0,0|0,0,0]=2 158 B9R1.13 CC(=O)CN1CCCC1 F50500 [1,0,0,1,0,0|1,0,0]=3 159 B9R1.13 C[C@H](N)CC1CCCC1 N12947 [1,0,0,1,0,0|1,0,1]=4 160 B9R1.13 O=C(O)C[C@H]1CCNC1 P11648 [1,0,0,1,0,0|2,0,0]=4 161 B9R1.41 CC(=O)[C@@H]1CCCC1=O F17111 [1,0,0,1,0,0|1,0,1]=4 162 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O W10213 [1,0,0,1,0,0|2,0,0]=4 163 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O AT17205 [1,0,0,1,0,0|2,0,0]=4 164 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O AT13997 [1,0,0,1,0,0|2,0,0]=4 165 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O AT13975 [1,0,0,1,0,0|2,0,0]=4 166 B9R1.48 CN1CCCNC(=O)C1 AT20054 [1,0,0,1,0,0|2,0,0]=4 167 B9R1.84 O=[N+]([O-])CCC1CCC1 FD10612 [1,0,0,1,0,0|2,0,0]=4 168 B9R1.85 O=C(O)CCNC1CC1 AC5323 [1,0,0,1,0,0|2,0,0]=4 169 B9R1.85 O=C(O)COCC1CC1 12497 [1,0,0,1,0,0|2,0,0]=4 170 B9R1.96 CC(=O)N1CC[C@@H]1CO P19109 [1,0,0,1,0,0|2,0,0]=4 171 B9R1.96 CCC1CN[C@@H]1C(=O)O P15219 [1,0,0,1,0,0|2,0,0]=4 172 B11R1.16 CCCC(=O)C1CCNCC1 F16039 [0,1,0,1,0,0|1,0,0]=3 173 B11R1.16 CCNC(=O)N1CCNCC1 AT22987 [0,1,0,1,0,0|2,0,0]=4 174 B11R1.16 CCOC(=O)[C@@H]1CNCCS1 H11960 [0,1,0,1,0,0|2,0,0]=4 175 B11R1.16 CCOC(=O)[C@@H]1COCCN1 77675 [0,1,0,1,0,0|2,0,0]=4 176 B11R1.16 CCOC(=O)[C@H]1CCCNC1 56329 [0,1,0,1,0,0|1,0,0]=3 177 B11R1.16 CN(CCN)C1CCCCC1 73370 [0,1,0,1,0,0|2,0,0]=4 178 B11R1.16 COCC(=O)N1CCNCC1 P10687 [0,1,0,1,0,0|2,0,0]=4 179 B11R1.24 CCCC[C@H]1CC(=O)CCN1 S11327 [0,1,0,1,0,0|0,0,0]=2 180 B11R1.30 CCOC(=O)C[C@H]1CCCN1 F14054 [0,1,0,1,0,0|1,0,0]=3 181 B11R1.30 CCOC(=O)C[C@H]1CCCN1 F14113 [0,1,0,1,0,0|1,0,0]=3 182 B11R1.30 NCCC(=O)NC1CCCC1 F21050 [0,1,0,1,0,0|1,0,0]=3 183 B11R1.180 CNCCCN1CCOC1=O AT18748 [0,1,0,1,0,0|2,0,0]=4 184 B11R1.199 CCOC(=O)C1CSCC1N 69819 [0,1,0,1,0,0|2,0,0]=4 185 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N 98153 [0,1,0,1,0,0|1,0,0]=3 186 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N AC7745 [0,1,0,1,0,0|1,0,0]=3 187 B11R1.199 CCOC(=O)[C@H]1CNC[C@@H]1C 72681 [0,1,0,1,0,0|1,0,0]=3 188 B11R1.289 CCOC(=O)CCC1CCC1 F52482 [0,1,0,1,0,0|0,0,0]=2 189 B11R1.290 CCOC(=O)CCNC1CC1 AC6776 [0,1,0,1,0,0|1,0,0]=3 190 B11R1.39 COC(=O)C[C@@H]1C[C@H](O)CN1 F51547 [0,1,0,1,0,0|2,0,0]=4 191 B11R1.39 COC(=O)C[C@H]1CCC(=O)C1 80323 [0,1,0,1,0,0|1,0,1]=4 192 B11R1.39 COC(=O)C[C@H]1CCC(=O)C1 88865 [0,1,0,1,0,0|1,0,1]=4 193 B11R1.40 CNC(=O)NC1CCNCC1 AT22991 [0,1,0,1,0,0|2,0,0]=4 194 B11R1.40 CNC(=O)OC1CCNCC1 AT22998 [0,1,0,1,0,0|2,0,0]=4 195 B11R1.40 COC(=O)C[C@H]1CCCNC1 AB9802 [0,1,0,1,0,0|1,0,0]=3 196 B11R1.40 COC(=O)C[C@H]1CNCCN1 D79031 [0,1,0,1,0,0|2,0,0]=4 197 B11R1.40 COC(=O)C[C@H]1CNCCN1 S11350 [0,1,0,1,0,0|2,0,0]=4 198 B11R1.40 COC(=O)C[C@H]1CNCCO1 F17624 [0,1,0,1,0,0|2,0,0]=4 199 B11R1.40 COC(=O)C[C@H]1CNCCO1 F18995 [0,1,0,1,0,0|2,0,0]=4 200 B11R1.40 COC(=O)C[C@H]1CNCCO1 F18996 [0,1,0,1,0,0|2,0,0]=4 201 B11R1.40 COC(=O)C[C@H]1CNCCO1 F18999 [0,1,0,1,0,0|2,0,0]=4 202 B11R1.40 COC(=O)C[C@H]1COCCN1 73924 [0,1,0,1,0,0|2,0,0]=4 203 B11R1.40 COC(=O)C[C@H]1COCCN1 F14597 [0,1,0,1,0,0|2,0,0]=4 204 B11R1.40 COC(=O)C[C@H]1COCCO1 AT10081 [0,1,0,1,0,0|2,0,0]=4 205 B11R1.222 COC(=O)C1CCCCC1N F52864 [0,1,0,1,0,0|1,0,0]=3 206 B11R1.222 COC(=O)C1CCCCC1O D76886 [0,1,0,1,0,0|1,0,0]=3 207 B11R1.222 COC(=O)C1CCCNC1C F30030 [0,1,0,1,0,0|1,0,0]=3 208 B11R1.222 COC(=O)C1COCCC1N D87017 [0,1,0,1,0,0|2,0,0]=4 209 B11R1.222 COC(=O)C1NCCCC1O AC4816 [0,1,0,1,0,0|2,0,0]=4 210 B11R1.222 COC(=O)N1CCNC[C@@H]1C AT22989 [0,1,0,1,0,0|2,0,0]=4 211 B11R1.222 COC(=O)[C@H]1CCCC[C@@H]1N 20978 [0,1,0,1,0,0|1,0,0]=3 212 B11R1.222 COC(=O)[C@H]1CCCN[C@H]1C AC4979 [0,1,0,1,0,0|1,0,0]=3 213 B11R1.23 COC(=O)C1CC(O)CCN1 F30520 [0,1,0,1,0,0|2,0,0]=4 214 B11R1.23 COC(=O)C1CCNC(C)C1 92946 [0,1,0,1,0,0|2,0,0]=4 215 B11R1.23 COC(=O)C1CCNC(C)C1 F20889 [0,1,0,1,0,0|2,0,0]=4 216 B11R1.23 COC(=O)C1CNCC(F)C1 92537 [0,1,0,1,0,0|2,0,0]=4 217 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 55807 [0,1,0,1,0,0|1,0,0]=3 218 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 D96778 [0,1,0,1,0,0|1,0,0]=3 219 B11R1.23 COC(=O)[C@@H]1C[C@@H](O)CCN1 AT22151 [0,1,0,1,0,0|2,0,0]=4 220 B11R1.23 COC(=O)[C@@H]1C[C@H](O)CCN1 E72332 [0,1,0,1,0,0|2,0,0]=4 221 B11R1.23 COC(=O)[C@H]1CCC[C@H](N)C1 P17832 [0,1,0,1,0,0|1,0,0]=3 222 B11R1.75 CC(C)NC[C@H]1CCC(=O)N1 AT19167 [0,1,0,1,0,0|2,0,0]=4 223 B11R1.227 CC1(C)CCCN1C(=O)CBr 70337 [0,1,0,1,0,0|2,0,0]=4 224 B11R1.227 COC(=O)[C@H]1CNCC1(C)C F12540 [0,1,0,1,0,0|2,0,0]=4 225 B11R1.22 C=C1CCC(C(=O)OC)CC1 AT23745 [0,1,0,1,0,0|1,0,1]=4 226 B11R1.22 CC[C@H](C)C1CCC(N)CC1 T70675 [0,1,0,1,0,0|1,0,1]=4 227 B11R1.22 CNC(=O)N1CCC(N)CC1 AT22995 [0,1,0,1,0,0|2,0,0]=4 228 B11R1.22 CNC(=O)[C@H]1CC[C@H](N)CC1 D96644 [0,1,0,1,0,0|1,0,0]=3 229 B11R1.22 COC(=O)C1CCC(O)CN1 F30865 [0,1,0,1,0,0|2,0,0]=4 230 B11R1.22 COC(=O)N1CCC(N)CC1 AT23027 [0,1,0,1,0,0|2,0,0]=4 231 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 70015 [0,1,0,1,0,0|2,0,0]=4 232 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 P14642 [0,1,0,1,0,0|2,0,0]=4 233 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 P19193 [0,1,0,1,0,0|2,0,0]=4 234 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 W19558 [0,1,0,1,0,0|2,0,0]=4 235 B11R1.22 NC1CCN(C(=O)CO)CC1 F50460 [0,1,0,1,0,0|2,0,0]=4 236 B11R1.44 COC(=O)C1CCC(CO)C1 AT13550 [0,1,0,1,0,0|2,0,0]=4 237 B11R1.44 COC(=O)[C@H]1CC[C@@H](CBr)C1 D95216 [0,1,0,1,0,0|2,0,0]=4 238 B11R1.1 CNCCC1CCN(C)CC1 AC8437 [0,1,0,1,0,0|2,0,0]=4 239 B11R1.25 COC(=O)CCN1CCCC1 D72568 [0,1,0,1,0,0|1,0,0]=3 240 B11R1.25 COC(=O)CNC1CCCC1 AB10047 [0,1,0,1,0,0|1,0,0]=3 241 B11R1.25 COC(=O)CO[C@H]1CCNC1 F13057 [0,1,0,1,0,0|2,0,0]=4 242 B11R1.115 COC(=O)[C@@H]1CCN1CCF P15233 [0,1,0,1,0,0|2,0,0]=4 243 B11R1.852 COC(=O)[C@@H]1CCCCCN1 I11326 [0,1,0,1,0,0|1,0,0]=3 244 B11R1.852 COC(=O)[C@@H]1CNCCCO1 AC5424 [0,1,0,1,0,0|2,0,0]=4 245 B11R1.852 COC(=O)[C@H]1CCCNCC1 P11164 [0,1,0,1,0,0|1,0,0]=3 246 B11R1.35 CC(C)C(=O)N[C@H]1CCNC1 F21060 [0,1,0,1,0,0|2,0,0]=4 247 B11R1.35 C[C@H](N)C(=O)OC1CCCC1 96784 [0,1,0,1,0,0|1,0,0]=3 248 B11R1.36 CN(C)C(=O)[C@@H]1CCCCN1 C78180 [0,1,0,1,0,0|2,0,0]=4 249 B11R1.36 CN(C)C(=O)[C@H]1CCCNC1 C71430 [0,1,0,1,0,0|2,0,0]=4 250 B11R1.36 C[C@H](O)C(=O)N1CCOCC1 12344 [0,1,0,1,0,0|2,0,0]=4 251 B11R1.332 C[C@H](N)C(=O)OCC1CCC1 A50623 [0,1,0,1,0,0|1,0,0]=3 252 B11R1.31 COC(=O)[C@H](C)N1CCCC1 AC5167 [0,1,0,1,0,0|2,0,0]=4 253 B11R1.293 COC(=O)[C@@H](O)CC1CCC1 69649 [0,1,0,1,0,0|1,0,0]=3 254 B11R1.878 COC(=O)C1(N)CCNCC1 AC4598 [0,1,0,1,0,0|2,0,0]=4 255 B11R1.878 COC(=O)[C@@]1(C)CCCOC1 P19960 [0,1,0,1,0,0|2,0,0]=4 256 B11R1.878 COC(=O)[C@]1(F)CCCNC1 AT26769 [0,1,0,1,0,0|2,0,0]=4 257 B11R2.36 O=C1CCC2CCNC2C1 D72799 [0,0,0,2,0,0|1,0,0]=3 258 B11R2.357 O=C1CCN2CCCC1C2 AT13094 [0,0,0,2,0,0|1,0,0]=3 259 B11R2.742 O=C1C=CC2(CCC2)CC1 F19772 [0,0,0,2,0,0|0,0,2]=4 260 B11R2.742 O=C1COC2(CCC2)CN1 W15926 [0,0,0,2,0,0|2,0,0]=4 261 B11R2.106 O=C1CCCN2CCC[C@@H]12 C15384 [0,0,0,2,0,0|1,0,0]=3 262 B11R2.106 O=C1CCNC2CCCC12 F14781 [0,0,0,2,0,0|1,0,0]=3 263 B11R2.106 O=C1CCNC2CCCC12 P10663 [0,0,0,2,0,0|1,0,0]=3 264 B11R2.106 O=C1CNC[C@@H]2CCCN12 90666 [0,0,0,2,0,0|2,0,0]=4 265 B11R2.106 O=C1CNC[C@@H]2CCCN12 F53864 [0,0,0,2,0,0|2,0,0]=4 266 B11R2.106 O=C1CNC[C@@H]2CCCN12 N13360 [0,0,0,2,0,0|2,0,0]=4 267 B11R2.106 O=C1OCCC2CCNC12 33376 [0,0,0,2,0,0|2,0,0]=4 268 B11R2.1 O=C1CC[C@H]2CNCCN12 F18941 [0,0,0,2,0,0|2,0,0]=4 269 B11R2.1 O=C1NCC2CNCCC12 P13958 [0,0,0,2,0,0|2,0,0]=4 270 B11R2.1 O=C1OC[C@H]2CCCCN12 D87354 [0,0,0,2,0,0|2,0,0]=4 271 B11R2.12 O=C1CCC12CCOCC2 84581 [0,0,0,2,0,0|1,0,0]=3 272 B11R2.40 NC1(C2CCCCC2)CC1 94852 [0,0,0,2,0,0|1,0,1]=4 273 B11R2.905 COC(=O)[C@@H]1[C@H]2CNC[C@H]21 P11054 [0,0,0,2,0,0|2,0,0]=4 274 B11R2.905 COC(=O)[C@H]1[C@H]2CNC[C@H]21 AT16122 [0,0,0,2,0,0|2,0,0]=4 275 B11R2.914 COC(=O)[C@@H]1C[C@@H]2O[C@@H]2C1 F16318 [0,0,0,2,0,0|2,0,0]=4 276 B11R2.10 O=C1C[C@@H]2CCCC[C@@H]2N1 AT25973 [0,0,0,2,0,0|1,0,0]=3 277 B11R2.352 O=C1C[C@H](C2CCC2)CN1 AT19188 [0,0,0,2,0,0|1,0,0]=3 278 B11R2.359 O=C1CC2CCC(CN1)N2 AT25155 [0,0,0,2,0,0|2,0,0]=4