0 B8R0.8 C=CCC[C@H](N)C(=O)O A41502 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.8 CCCCC(=O)[C@H](C)N A46508 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.8 CCCC[C@H](N)C(=O)O A68582 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.8 CSCC[C@H](N)C(=O)O M60616 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.3 C=CC(=O)NCCN A41315 [1,0,0,0,0,0|2,0,0]=3 5 B7R0.3 CCCCC(=O)NN P40425 [1,0,0,0,0,0|3,0,0]=4 6 B7R0.3 COC(=O)CCCBr M39189 [1,0,0,0,0,0|3,0,0]=4 7 B7R0.3 COC(=O)CCCCl M60517 [1,0,0,0,0,0|3,0,0]=4 8 B7R0.3 COC(=O)CCCN M32376 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.4 C#CCCCC(=O)O H43301 [1,0,0,0,0,0|1,0,2]=4 10 B7R0.4 CC(=O)CCCCBr B41532 [1,0,0,0,0,0|2,0,1]=4 11 B7R0.4 CC(=O)OCCCBr B41266 [1,0,0,0,0,0|3,0,0]=4 12 B7R0.4 CC(=O)OCCCCl C39190 [1,0,0,0,0,0|3,0,0]=4 13 B7R0.4 CCCCOC(N)=O B39165 [1,0,0,0,0,0|3,0,0]=4 14 B7R0.4 CCCOCC(=O)O P40387 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.4 CCC\C=C\C(=O)O H41460 [1,0,0,0,0,0|1,0,1]=3 16 B7R0.4 CCOC=CC(=O)O E41226 [1,0,0,0,0,0|2,0,1]=4 17 B7R0.4 CNCCCC(=O)O M63276 [1,0,0,0,0,0|2,0,1]=4 18 B7R0.4 COCCCC(=O)O M67387 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.4 COC\C=C\C(=O)O M63576 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.4 N#CCCCC(=O)O C41166 [1,0,0,0,0,0|0,0,3]=4 21 B7R0.4 O=C(O)CCCCBr B39187 [1,0,0,0,0,0|1,0,1]=3 22 B7R0.4 O=C(O)CCCCCl C39191 [1,0,0,0,0,0|1,0,1]=3 23 B7R0.4 O=C(O)CCCCO H37199 [1,0,0,0,0,0|1,0,1]=3 24 B7R0.4 O=C(O)CNCCO H40270 [1,0,0,0,0,0|2,0,1]=4 25 B7R0.4 O=C(O)COCCCl C40236 [1,0,0,0,0,0|2,0,1]=4 26 B7R0.4 O=C([O-])CCCCO S41306 [1,0,0,0,0,0|1,0,2]=4 27 B7R0.5 CCC=C(C)C(=O)O M39198 [1,0,0,0,0,0|1,0,1]=3 28 B7R0.5 CCC[C@@H](N)C(=O)O N40406 [1,0,0,0,0,0|1,0,1]=3 29 B7R0.5 CCC[C@H](O)C(=O)O H40390 [1,0,0,0,0,0|0,0,2]=3 30 B7R0.5 CCOC(=O)C(=O)O E36772 [1,0,0,0,0,0|1,0,0]=2 31 B7R0.5 CCOC(=O)C(C)=O E60800 [1,0,0,0,0,0|2,0,0]=3 32 B7R0.5 CCOC(=O)C(N)=O E60589 [1,0,0,0,0,0|2,0,0]=3 33 B7R0.5 CCOC(=O)C(N)=S E15645 [1,0,0,0,0,0|2,1,0]=4 34 B7R0.5 CCOC(=O)[C@@H](C)O E68607 [1,0,0,0,0,0|2,0,1]=4 35 B7R0.5 CC\C=C(/C)C(=O)O M41462 [1,0,0,0,0,0|1,0,1]=3 36 B7R0.5 COC[C@@H](N)C(=O)O A40353 [1,0,0,0,0,0|2,0,1]=4 37 B7R0.5 COC[C@@H](N)C(=O)O A61058 [1,0,0,0,0,0|2,0,1]=4 38 B7R0.5 COC[C@H](Br)C(=O)O B40233 [1,0,0,0,0,0|2,0,1]=4 39 B7R0.5 COC[C@H](N)C(=O)O A40354 [1,0,0,0,0,0|2,0,1]=4 40 B7R0.5 COC[C@H](N)C(=O)O A67760 [1,0,0,0,0,0|2,0,1]=4 41 B7R0.5 NCC[C@@H](N)C(=O)O D40355 [1,0,0,0,0,0|1,0,1]=3 42 B7R0.5 NCC[C@H](F)C(=O)O A63044 [1,0,0,0,0,0|1,0,1]=3 43 B7R0.5 NCC[C@H](N)C(=O)O D37858 [1,0,0,0,0,0|1,0,1]=3 44 B7R0.5 NCC[C@H](N)C(=O)O D68313 [1,0,0,0,0,0|1,0,1]=3 45 B7R0.5 NCC[C@H](O)C(=O)O A39157 [1,0,0,0,0,0|0,0,2]=3 46 B7R0.5 NOC[C@H](N)C(=O)O A39931 [1,0,0,0,0,0|2,0,1]=4 47 B7R0.5 N[C@@H](CCBr)C(=O)O A37762 [1,0,0,0,0,0|2,0,1]=4 48 B7R0.5 N[C@@H](CCO)C(=O)O A68603 [1,0,0,0,0,0|2,0,1]=4 49 B7R0.5 N[C@@H](CCS)C(=O)O H68345 [1,0,0,0,0,0|2,0,1]=4 50 B7R0.5 N[C@H](CCO)C(=O)O A68363 [1,0,0,0,0,0|2,0,1]=4 51 B7R0.5 N[C@H](CCS)C(=O)O A66150 [1,0,0,0,0,0|2,0,1]=4 52 B9R0.7 CC(C)CC[C@@H](N)C(=O)O A43927 [0,1,0,0,0,0|2,0,1]=4 53 B9R0.8 CCCC[C@H](N)C(=O)OC M46518 [0,1,0,0,0,0|2,0,1]=4 54 B9R0.8 COC(=O)[C@@H](Br)CCCBr M41466 [0,1,0,0,0,0|2,0,1]=4 55 B9R0.8 CON(C)C(=O)CCCCl C41545 [0,1,0,0,0,0|3,0,0]=4 56 B9R0.47 C=C(C)C(=O)NCCCN A46499 [0,1,0,0,0,0|2,0,0]=3 57 B9R0.47 C=CCCC[C@H](N)C(=O)O A43841 [0,1,0,0,0,0|2,0,1]=4 58 B9R0.47 CCCCC[C@@H](N)C(=O)O A43920 [0,1,0,0,0,0|2,0,1]=4 59 B9R0.47 CCCCC[C@H](N)C(=O)O A43919 [0,1,0,0,0,0|2,0,1]=4 60 B9R0.47 CCCCC[C@H](N)C(=O)O A43921 [0,1,0,0,0,0|2,0,1]=4 61 B9R0.47 NCCCC[C@@H](N)C(=O)O L64962 [0,1,0,0,0,0|1,0,1]=3 62 B9R0.47 NCCCC[C@H](N)C(N)=O D43569 [0,1,0,0,0,0|2,0,1]=4 63 B9R1.5 CN1CCCNCC1=O M1178 [0,0,0,1,0,0|3,0,0]=4 64 B9R1.6 NC(=O)[C@@H]1CCCNC1 P12324 [0,0,0,1,0,0|2,0,1]=4 65 B9R1.6 NC(=O)[C@@H]1CCCNC1 P7512 [0,0,0,1,0,0|2,0,1]=4 66 B9R1.6 NC(=O)[C@H]1CCCNC1 P12323 [0,0,0,1,0,0|2,0,1]=4 67 B9R1.6 NC(=O)[C@H]1CCCNC1 P7513 [0,0,0,1,0,0|2,0,1]=4 68 B9R1.6 O=C(O)C1=CCCCO1 D43311 [0,0,0,1,0,0|1,0,2]=4 69 B9R1.6 O=C(O)C1=COCCC1 D23573 [0,0,0,1,0,0|2,0,0]=3 70 B9R1.6 O=C(O)C1CCCCC1 C64950 [0,0,0,1,0,0|2,0,1]=4 71 B9R1.6 O=C(O)N1CCCCC1 P62582 [0,0,0,1,0,0|3,0,0]=4 72 B9R1.6 O=C(O)[C@@H]1CCCCN1 P43440 [0,0,0,1,0,0|2,0,1]=4 73 B9R1.6 O=C(O)[C@@H]1CCCCN1 P43443 [0,0,0,1,0,0|2,0,1]=4 74 B9R1.6 O=C(O)[C@@H]1CCCCO1 T31331 [0,0,0,1,0,0|1,0,2]=4 75 B9R1.6 O=C(O)[C@@H]1CCCNC1 P12310 [0,0,0,1,0,0|1,0,1]=3 76 B9R1.6 O=C(O)[C@@H]1CNCCN1 P10721 [0,0,0,1,0,0|2,0,1]=4 77 B9R1.6 O=C(O)[C@@H]1CNCCN1 P11877 [0,0,0,1,0,0|2,0,1]=4 78 B9R1.6 O=C(O)[C@@H]1CNCCN1 P13373 [0,0,0,1,0,0|2,0,1]=4 79 B9R1.6 O=C(O)[C@@H]1CNCCN1 P41382 [0,0,0,1,0,0|2,0,1]=4 80 B9R1.6 O=C(O)[C@@H]1CNCCO1 M41374 [0,0,0,1,0,0|2,0,1]=4 81 B9R1.6 O=C(O)[C@@H]1CNCCO1 M61070 [0,0,0,1,0,0|2,0,1]=4 82 B9R1.6 O=C(O)[C@H]1CCCCN1 P28251 [0,0,0,1,0,0|2,0,1]=4 83 B9R1.6 O=C(O)[C@H]1CCCNC1 P12311 [0,0,0,1,0,0|1,0,1]=3 84 B9R1.6 O=C(O)[C@H]1CCCNC1 P43444 [0,0,0,1,0,0|1,0,1]=3 85 B9R1.6 O=C(O)[C@H]1CCCOC1 T0697 [0,0,0,1,0,0|2,0,1]=4 86 B9R1.6 O=C(O)[C@H]1CCCSC1 T1163 [0,0,0,1,0,0|2,0,1]=4 87 B9R1.6 O=C(O)[C@H]1CNCCN1 P10722 [0,0,0,1,0,0|2,0,1]=4 88 B9R1.6 O=C(O)[C@H]1CNCCN1 P11878 [0,0,0,1,0,0|2,0,1]=4 89 B9R1.6 O=C(O)[C@H]1CNCCO1 M18388 [0,0,0,1,0,0|2,0,1]=4 90 B9R1.6 O=C(O)[C@H]1CNCCO1 M63934 [0,0,0,1,0,0|2,0,1]=4 91 B9R1.23 CN1C[C@@H](CN)CC1=O A10326 [0,0,0,1,0,0|3,0,0]=4 92 B9R1.35 CC(=O)N1CC[C@H](N)C1 A14633 [0,0,0,1,0,0|3,0,0]=4 93 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 M60259 [0,0,0,1,0,0|2,0,1]=4 94 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 M60278 [0,0,0,1,0,0|2,0,1]=4 95 B9R1.35 NC1CCC(C(=O)O)C1 A11845 [0,0,0,1,0,0|1,0,1]=3 96 B9R1.35 NC1CCC(C(=O)O)C1 A15670 [0,0,0,1,0,0|1,0,1]=3 97 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 A15249 [0,0,0,1,0,0|1,0,1]=3 98 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 A20649 [0,0,0,1,0,0|1,0,1]=3 99 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 A15248 [0,0,0,1,0,0|1,0,1]=3 100 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 A43449 [0,0,0,1,0,0|1,0,1]=3 101 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 A41383 [0,0,0,1,0,0|2,0,1]=4 102 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 A41384 [0,0,0,1,0,0|2,0,1]=4 103 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 A25040 [0,0,0,1,0,0|1,0,1]=3 104 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 A43450 [0,0,0,1,0,0|1,0,1]=3 105 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 A60941 [0,0,0,1,0,0|2,0,1]=4 106 B9R1.35 O=C(O)C1CCC(O)C1 H41473 [0,0,0,1,0,0|2,0,1]=4 107 B9R1.69 CN1CC[C@H](N)CC1=O A0206 [0,0,0,1,0,0|3,0,0]=4 108 B9R1.69 CN1CC[C@H](N)CC1=O M7462 [0,0,0,1,0,0|3,0,0]=4 109 B9R1.69 CN1C[C@@H](N)CCC1=O A0588 [0,0,0,1,0,0|3,0,0]=4 110 B9R1.69 CN1C[C@@H](N)CCC1=O A12740 [0,0,0,1,0,0|3,0,0]=4 111 B9R1.95 NCC1CC(C(=O)O)C1 A15397 [0,0,0,1,0,0|1,0,1]=3 112 B9R1.95 NCC1CC(C(=O)O)C1 A30087 [0,0,0,1,0,0|1,0,1]=3 113 B9R1.95 O=C(O)C1CC(CO)C1 H11330 [0,0,0,1,0,0|2,0,1]=4 114 B9R1.110 CC(C(=O)O)C1CCO1 X59781 [0,0,0,1,0,0|2,0,1]=4 115 B9R1.110 N[C@@H](C(=O)O)C1CCC1 A12996 [0,0,0,1,0,0|2,0,1]=4 116 B9R1.110 N[C@H](C(=O)O)C1CCC1 A10555 [0,0,0,1,0,0|2,0,1]=4 117 B9R1.110 N[C@H](C(=O)O)C1CCC1 A12995 [0,0,0,1,0,0|2,0,1]=4 118 B9R1.112 N[C@@H](CC1CC1)C(=O)O A41508 [0,0,0,1,0,0|2,0,1]=4 119 B9R1.112 N[C@H](CC1CC1)C(=O)O C68587 [0,0,0,1,0,0|2,0,1]=4 120 B9R1.163 C[C@@]1(C(=O)O)CCCN1 M20146 [0,0,0,1,0,0|1,0,1]=3 121 B9R1.163 C[C@]1(C(=O)O)CCCN1 M17794 [0,0,0,1,0,0|1,0,1]=3 122 B9R1.163 C[C@]1(C(=O)O)CCCN1 M7933 [0,0,0,1,0,0|1,0,1]=3 123 B9R1.163 O=C(O)C1(F)CCCC1 F38406 [0,0,0,1,0,0|2,0,1]=4 124 B9R1.163 O=C(O)C1(O)CCCC1 H41472 [0,0,0,1,0,0|1,0,2]=4 125 B9R0.4 CC(=O)CC(=O)NCCO H41517 [0,0,0,0,0,1|3,0,0]=4 126 B6R0.1 CCOC(=O)CO E37817 [2,0,0,0,0,0|1,0,1]=4 127 B6R0.1 CNC(=O)CCN A40306 [2,0,0,0,0,0|2,0,0]=4 128 B6R0.1 COC(=O)CCN M67902 [2,0,0,0,0,0|2,0,0]=4 129 B6R0.4 C#CCCC(=O)O P68088 [2,0,0,0,0,0|1,0,1]=4 130 B6R0.4 C=CCCC(=O)O P37823 [2,0,0,0,0,0|1,0,1]=4 131 B6R0.4 CC(=O)CCCCl C68599 [2,0,0,0,0,0|1,0,1]=4 132 B6R0.4 CC(=O)NCCN A68626 [2,0,0,0,0,0|1,0,1]=4 133 B6R0.4 CCCCC(=O)[O-] S38573 [2,0,0,0,0,0|0,0,2]=4 134 B6R0.4 CCCOC(N)=O P40264 [2,0,0,0,0,0|2,0,0]=4 135 B6R0.4 CNCCC(=O)O M40350 [2,0,0,0,0,0|1,0,1]=4 136 B6R0.4 COCCC(=O)O M40255 [2,0,0,0,0,0|1,0,1]=4 137 B6R0.4 N#CCCC(=O)O C69146 [2,0,0,0,0,0|0,0,2]=4 138 B6R0.4 NCCCC(N)=O A40304 [2,0,0,0,0,0|1,0,0]=3 139 B6R0.4 O=C(O)CCCBr B39154 [2,0,0,0,0,0|1,0,0]=3 140 B6R0.4 O=C(O)CCCCl C40232 [2,0,0,0,0,0|1,0,0]=3 141 B6R0.4 O=C(O)\C=C\CBr B37272 [2,0,0,0,0,0|1,0,1]=4 142 B6R0.6 CC=CCCCO H41548 [2,0,0,0,0,0|2,0,0]=4 143 B6R0.6 O=CCCCCCl C41277 [2,0,0,0,0,0|1,0,1]=4 144 B6R0.6 O=CCCCCO H32202 [2,0,0,0,0,0|1,0,1]=4 145 B6R0.3 C=C(CBr)C(=O)O B40169 [2,0,0,0,0,0|2,0,0]=4 146 B6R0.3 CCC(=O)C(=O)[O-] S40297 [2,0,0,0,0,0|0,0,1]=3 147 B6R0.3 CC[C@@H](C)C(=O)O M40381 [2,0,0,0,0,0|1,0,1]=4 148 B6R0.3 CC[C@H](N)C(=O)O A40349 [2,0,0,0,0,0|1,0,1]=4 149 B6R0.3 CC[C@H](N)C(=O)O A68376 [2,0,0,0,0,0|1,0,1]=4 150 B6R0.3 CC[C@H](O)C(=O)O H23105 [2,0,0,0,0,0|0,0,2]=4 151 B6R0.3 C[C@H](CN)C(=O)O A40352 [2,0,0,0,0,0|1,0,1]=4 152 B6R0.3 NC[C@@H](O)C(=O)O A39878 [2,0,0,0,0,0|0,0,2]=4 153 B6R0.3 NC[C@H](N)C(=O)O D39929 [2,0,0,0,0,0|1,0,1]=4 154 B6R0.3 NC[C@H](O)C(=O)O S39877 [2,0,0,0,0,0|0,0,2]=4 155 B8R0.1 CCOC(=O)CCCN E43487 [1,1,0,0,0,0|1,0,1]=4 156 B8R0.6 CNCCCC(=O)OC M43486 [1,1,0,0,0,0|2,0,0]=4 157 B8R0.6 COC(=O)CCCCN M43490 [1,1,0,0,0,0|2,0,0]=4 158 B8R0.5 CCC[C@H](N)CC(=O)O A43488 [1,1,0,0,0,0|1,0,1]=4 159 B8R0.5 CCC\C(C)=C\C(=O)O M62391 [1,1,0,0,0,0|1,0,1]=4 160 B8R0.7 C#CCCCCC(=O)O H43713 [1,1,0,0,0,0|1,0,1]=4 161 B8R0.7 C=CCCCCC(=O)O H63383 [1,1,0,0,0,0|1,0,1]=4 162 B8R0.7 NCCNCCC(=O)[O-] S41302 [1,1,0,0,0,0|0,0,2]=4 163 B8R0.7 NCCOCCC(=O)O A40415 [1,1,0,0,0,0|0,0,1]=3 164 B8R0.7 O=C(O)CCCCCBr B67880 [1,1,0,0,0,0|1,0,1]=4 165 B8R0.7 O=C(O)CCCCCCl C41527 [1,1,0,0,0,0|1,0,1]=4 166 B8R0.7 O=C(O)CCOCCBr B41274 [1,1,0,0,0,0|1,0,1]=4 167 B8R0.21 NCCCCP(=O)(O)O A69195 [1,1,0,0,0,0|1,0,1]=4 168 B8R0.23 CC(=O)C(=O)OC(C)C P65400 [1,1,0,0,0,0|2,0,0]=4 169 B8R0.23 CC(C)C[C@@H](N)C(=O)O L64923 [1,1,0,0,0,0|1,0,1]=4 170 B8R0.23 CC(C)C[C@@H](O)C(=O)O H41559 [1,1,0,0,0,0|0,0,2]=4 171 B8R0.23 CC(C)C[C@H](Br)C(=O)O B41525 [1,1,0,0,0,0|1,0,1]=4 172 B8R0.23 CC(C)C[C@H](Br)C(=O)O B41526 [1,1,0,0,0,0|1,0,1]=4 173 B8R0.23 CC(C)C[C@H](O)C(=O)O H37072 [1,1,0,0,0,0|0,0,2]=4 174 B10R0.18 C#CCCC(=O)CC(=O)OC M61281 [0,1,0,0,0,1|1,0,1]=4 175 B10R0.18 CCCCC(=O)CC(=O)OC M47093 [0,1,0,0,0,1|1,0,0]=3 176 B10R0.19 CCCCC(=O)C(=O)OCC E12153 [0,2,0,0,0,0|1,0,0]=3 177 B10R0.19 CCOC(=O)[C@@H](N)CCCN E63673 [0,2,0,0,0,0|1,0,1]=4 178 B10R0.83 COC(=O)[C@H](N)CCCCN M46606 [0,2,0,0,0,0|1,0,1]=4 179 B8R1.1 NC[C@@H]1CNC(=O)C1 A15732 [1,0,0,1,0,0|2,0,0]=4 180 B8R1.1 NC[C@@H]1CNC(=O)C1 A27672 [1,0,0,1,0,0|2,0,0]=4 181 B8R1.1 NC[C@@H]1CNC(=O)C1 A7263 [1,0,0,1,0,0|2,0,0]=4 182 B8R1.1 NC[C@H]1CNC(=O)C1 A18478 [1,0,0,1,0,0|2,0,0]=4 183 B8R1.1 NC[C@H]1CNC(=O)C1 A27671 [1,0,0,1,0,0|2,0,0]=4 184 B8R1.2 O=CC1=COCCC1 D43307 [1,0,0,1,0,0|2,0,0]=4 185 B8R1.3 NC1CCC(=O)CC1 A38581 [1,0,0,1,0,0|1,0,1]=4 186 B8R1.3 N[C@H]1CCC(=O)NC1 A0587 [1,0,0,1,0,0|2,0,0]=4 187 B8R1.5 C[C@H]1CCCNC1=O P23372 [1,0,0,1,0,0|1,0,1]=4 188 B8R1.5 N[C@@H]1CCCNC1=O A41314 [1,0,0,1,0,0|1,0,1]=4 189 B8R1.5 N[C@H]1CCCNC1=O A38933 [1,0,0,1,0,0|1,0,1]=4 190 B8R1.5 N[C@H]1CCCNC1=O A41313 [1,0,0,1,0,0|1,0,1]=4 191 B8R1.5 N[C@H]1CCCNC1=O A64847 [1,0,0,1,0,0|1,0,1]=4 192 B8R1.5 O=C1CCCC=C1Br B3408 [1,0,0,1,0,0|2,0,0]=4 193 B8R1.5 O=C1CCCCC1=O C67839 [1,0,0,1,0,0|1,0,0]=3 194 B8R1.5 O=C1NCCC[C@@H]1Br B41219 [1,0,0,1,0,0|1,0,1]=4 195 B8R1.5 O=C1NCCC[C@@H]1O H36756 [1,0,0,1,0,0|0,0,2]=4 196 B8R1.22 O=C1C=CCCCC1 C67890 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.22 O=C1CCCNCC1 H12307 [1,0,0,1,0,0|1,0,1]=4 198 B8R1.38 COC(=O)[C@@H]1CCN1 M11233 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.38 COC(=O)[C@@H]1CCN1 M11611 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.38 COC(=O)[C@H]1CCN1 M11612 [1,0,0,1,0,0|2,0,0]=4 201 B8R1.4 N[C@H]1CCNC(=O)C1 A0054 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.4 N[C@H]1CCNC(=O)C1 A37105 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.7 NC(=O)[C@@H]1CCCN1 P23637 [1,0,0,1,0,0|1,0,1]=4 204 B8R1.7 NC(=O)[C@@H]1CCCN1 P64914 [1,0,0,1,0,0|1,0,1]=4 205 B8R1.7 NC(=O)[C@@H]1CCCN1 P67734 [1,0,0,1,0,0|1,0,1]=4 206 B8R1.7 NC(=O)[C@H]1CCCN1 P40370 [1,0,0,1,0,0|1,0,1]=4 207 B8R1.7 O=C(O)C1=CCCC1 C43305 [1,0,0,1,0,0|1,0,0]=3 208 B8R1.7 O=C(O)C1=COCC1 D8190 [1,0,0,1,0,0|2,0,0]=4 209 B8R1.7 O=C(O)C1CCCC1 C23144 [1,0,0,1,0,0|1,0,1]=4 210 B8R1.7 O=C(O)[C@@H]1CCCN1 P69799 [1,0,0,1,0,0|0,0,1]=3 211 B8R1.7 O=C(O)[C@@H]1CCCO1 T37842 [1,0,0,1,0,0|1,0,1]=4 212 B8R1.7 O=C(O)[C@@H]1CCCO1 X25975 [1,0,0,1,0,0|1,0,1]=4 213 B8R1.7 O=C(O)[C@@H]1CCCS1 T41225 [1,0,0,1,0,0|1,0,1]=4 214 B8R1.7 O=C(O)[C@@H]1COCN1 X40338 [1,0,0,1,0,0|1,0,1]=4 215 B8R1.7 O=C(O)[C@H]1CCCO1 T25974 [1,0,0,1,0,0|1,0,1]=4 216 B8R1.7 O=C(O)[C@H]1CSCN1 T63317 [1,0,0,1,0,0|1,0,1]=4 217 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O A13712 [1,0,0,1,0,0|0,0,1]=3 218 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O A13711 [1,0,0,1,0,0|0,0,1]=3 219 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O A13334 [1,0,0,1,0,0|0,0,1]=3 220 B8R1.31 N[C@H]1CC[C@H]1C(=O)O A13518 [1,0,0,1,0,0|0,0,1]=3 221 B8R1.31 N[C@H]1CC[C@H]1C(=O)O A29882 [1,0,0,1,0,0|0,0,1]=3 222 B8R1.31 O=C(O)C1CCC1F F59749 [1,0,0,1,0,0|1,0,1]=4 223 B8R1.34 O=C(O)C=C1CCC1 C10691 [1,0,0,1,0,0|1,0,1]=4 224 B8R1.34 O=C(O)CC1CCC1 C24745 [1,0,0,1,0,0|1,0,1]=4 225 B8R1.35 O=C(O)\C=C\C1CC1 C29885 [1,0,0,1,0,0|1,0,1]=4 226 B8R1.23 CC1CC(C(=O)O)C1 M14949 [1,0,0,1,0,0|1,0,1]=4 227 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 M10526 [1,0,0,1,0,0|1,0,1]=4 228 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 M10527 [1,0,0,1,0,0|1,0,1]=4 229 B8R1.23 NC1CC(C(=O)O)C1 A12181 [1,0,0,1,0,0|1,0,1]=4 230 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 A0232 [1,0,0,1,0,0|1,0,1]=4 231 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SB7470 [1,0,0,1,0,0|1,0,1]=4 232 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 A0233 [1,0,0,1,0,0|1,0,1]=4 233 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 SB7471 [1,0,0,1,0,0|1,0,1]=4 234 B8R1.54 N[C@@H](C(=O)O)C1CC1 A11037 [1,0,0,1,0,0|1,0,1]=4 235 B8R1.54 N[C@H](C(=O)O)C1CC1 A67725 [1,0,0,1,0,0|1,0,1]=4 236 B8R1.54 O=C(O)C(=O)C1CC1 C41121 [1,0,0,1,0,0|0,0,0]=2 237 B8R1.78 CC1(C(=O)O)CCC1 M11732 [1,0,0,1,0,0|1,0,1]=4 238 B8R1.78 NC1(C(=O)O)CCC1 A10609 [1,0,0,1,0,0|1,0,1]=4 239 B8R1.78 NC1(C(=O)O)CCC1 A26979 [1,0,0,1,0,0|1,0,1]=4 240 B10R1.18 O=C(O)C[C@H]1CCCNC1 P10342 [0,0,0,1,0,1|1,0,1]=4 241 B10R1.18 O=C(O)C[C@H]1CCCNC1 P46485 [0,0,0,1,0,1|1,0,1]=4 242 B10R1.266 CC(=O)CC(=O)C1CCC1 C6255 [0,0,0,1,0,1|2,0,0]=4 243 B10R1.275 O=C1CCCCC(O)=C1F F59968 [0,1,0,1,0,0|2,0,0]=4 244 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 A17080 [0,1,0,1,0,0|1,0,1]=4 245 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 A8201 [0,1,0,1,0,0|1,0,1]=4 246 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 A15622 [0,1,0,1,0,0|1,0,1]=4 247 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 T1863 [0,1,0,1,0,0|1,0,1]=4 248 B10R1.13 O=C1CCC(C(=O)O)=NN1 X61638 [0,1,0,1,0,0|1,0,1]=4 249 B10R1.14 COC(=O)C1CCC(N)C1 C13729 [0,1,0,1,0,0|1,0,1]=4 250 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 M14936 [0,1,0,1,0,0|1,0,1]=4 251 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 M14934 [0,1,0,1,0,0|1,0,1]=4 252 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 M14935 [0,1,0,1,0,0|1,0,1]=4 253 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 M14937 [0,1,0,1,0,0|1,0,1]=4 254 B10R1.15 COC(=O)C1=CCCCC1 M47018 [0,1,0,1,0,0|2,0,0]=4 255 B10R1.15 COC(=O)C1=CNCCC1 M29675 [0,1,0,1,0,0|1,0,0]=3 256 B10R1.15 COC(=O)C1=COCCC1 M43727 [0,1,0,1,0,0|2,0,0]=4 257 B10R1.15 COC(=O)[C@@H]1CCCNC1 M18060 [0,1,0,1,0,0|1,0,1]=4 258 B10R1.15 COC(=O)[C@@H]1CCCNC1 M21650 [0,1,0,1,0,0|1,0,1]=4 259 B10R1.15 COC(=O)[C@H]1CCCNC1 M21649 [0,1,0,1,0,0|1,0,1]=4 260 B10R1.15 COC(=O)[C@H]1CCCNC1 M26313 [0,1,0,1,0,0|1,0,1]=4 261 B10R1.169 COC(=O)C1CC(CN)C1 M20788 [0,1,0,1,0,0|1,0,1]=4 262 B10R1.411 COC(=O)[C@@]1(C)CCCN1 M15317 [0,1,0,1,0,0|1,0,1]=4 263 B10R1.411 COC(=O)[C@]1(C)CCCN1 M11864 [0,1,0,1,0,0|1,0,1]=4 264 B10R1.348 O=C(O)[C@H]1CCCNCC1 H1656 [0,1,0,1,0,0|1,0,1]=4 265 B10R1.477 CC[C@@]1(C(=O)O)CCCN1 E65271 [0,1,0,1,0,0|1,0,1]=4 266 B10R1.113 CN1CCC[C@H](C(=O)O)C1 M12564 [0,1,0,1,0,0|1,0,1]=4 267 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 M59674 [0,1,0,1,0,0|1,0,1]=4 268 B10R1.113 C[C@H]1CNC[C@@H](C(=O)O)C1 M59675 [0,1,0,1,0,0|1,0,1]=4 269 B10R1.113 C[C@H]1CNC[C@H](C(=O)O)C1 M59698 [0,1,0,1,0,0|1,0,1]=4 270 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 A15487 [0,1,0,1,0,0|1,0,1]=4 271 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 A27720 [0,1,0,1,0,0|1,0,1]=4 272 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 A27835 [0,1,0,1,0,0|1,0,1]=4 273 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 A13773 [0,1,0,1,0,0|1,0,1]=4 274 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 A15702 [0,1,0,1,0,0|1,0,1]=4 275 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 A27836 [0,1,0,1,0,0|1,0,1]=4 276 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 A46492 [0,1,0,1,0,0|1,0,1]=4 277 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 A27837 [0,1,0,1,0,0|1,0,1]=4 278 B10R1.363 C[C@@]1(C(=O)O)CCCCN1 M61881 [0,1,0,1,0,0|1,0,1]=4 279 B10R1.363 C[C@]1(C(=O)O)CCCCN1 M16273 [0,1,0,1,0,0|1,0,1]=4 280 B10R1.363 C[C@]1(C(=O)O)CCCNC1 M11314 [0,1,0,1,0,0|1,0,1]=4 281 B10R1.363 C[C@]1(C(=O)O)CCCNC1 M11315 [0,1,0,1,0,0|1,0,1]=4 282 B10R2.344 O=C(O)C12CNCC1C2 A11245 [0,0,0,2,0,0|1,0,1]=4 283 B10R2.344 O=C(O)[C@@]12CC1CCN2 A59678 [0,0,0,2,0,0|1,0,1]=4 284 B10R2.348 O=C(O)C12CC(CN1)C2 A15220 [0,0,0,2,0,0|1,0,1]=4