0 B8R0.8 CCCCC(=O)[C@H](C)N A46508 [0,0,0,0,0,0|1,0,1]=2 1 B8R0.8 CCCC[C@H](N)C(=O)O A68582 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.8 CSCCC(O)C(=O)[O-] C54080 [0,0,0,0,0,0|2,0,2]=4 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|2,0,1]=4 5 B7R0.3 CCCCC(=O)NN P40425 [1,0,0,0,0,0|2,0,0]=3 6 B7R0.3 CCCC[C@@H]([Mg+])CC E31708 [1,0,0,0,0,0|1,0,2]=4 7 B7R0.3 CCCOC(=O)OC M40388 [1,0,0,0,0,0|2,0,0]=3 8 B7R0.3 CNCCC(=O)OC M40412 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.3 COC(=N)CCCCl M40379 [1,0,0,0,0,0|3,0,0]=4 10 B7R0.3 COC(=O)CCCBr M39189 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.3 COC(=O)CCCCl M60517 [1,0,0,0,0,0|2,0,0]=3 12 B7R0.3 COC(=O)CCCN M32376 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.4 CC(=O)CCCCBr B41532 [1,0,0,0,0,0|1,0,1]=3 14 B7R0.4 CC(=O)OCCCBr B41266 [1,0,0,0,0,0|2,0,0]=3 15 B7R0.4 CC(=O)OCCCCl C39190 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.4 CCCCC[C@H](C)O H43947 [1,0,0,0,0,0|0,0,3]=4 17 B7R0.4 CCCCOC(N)=O B39165 [1,0,0,0,0,0|2,0,0]=3 18 B7R0.4 CCCOCC(=O)O P40387 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.4 CCC\C=C\C(=O)O H41460 [1,0,0,0,0,0|1,0,1]=3 20 B7R0.4 CCOC=CC(=O)O E41226 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.4 CNCCCC(=O)O M63276 [1,0,0,0,0,0|2,0,1]=4 22 B7R0.4 COCCCC(=O)O M67387 [1,0,0,0,0,0|2,0,1]=4 23 B7R0.4 COCCNC(N)=O M36648 [1,0,0,0,0,0|3,0,0]=4 24 B7R0.4 COC\C=C\C(=O)O M63576 [1,0,0,0,0,0|2,0,1]=4 25 B7R0.4 O=C(O)CCCCBr B39187 [1,0,0,0,0,0|2,0,1]=4 26 B7R0.4 O=C(O)CCCCCl C39191 [1,0,0,0,0,0|2,0,1]=4 27 B7R0.4 O=C(O)CCCCO H37199 [1,0,0,0,0,0|2,0,1]=4 28 B7R0.4 O=C([O-])CCCCO S41306 [1,0,0,0,0,0|2,0,1]=4 29 B7R0.5 CCC=C(C)C(=O)O M39198 [1,0,0,0,0,0|2,0,1]=4 30 B7R0.5 CCC[C@@H](N)C(=O)O N40406 [1,0,0,0,0,0|2,0,1]=4 31 B7R0.5 CCC[C@H](O)C(=O)O H40390 [1,0,0,0,0,0|1,0,2]=4 32 B7R0.5 CCOC(=O)C(=O)O E36772 [1,0,0,0,0,0|2,0,0]=3 33 B7R0.5 CCOC(=O)C(C)=O E60800 [1,0,0,0,0,0|1,0,0]=2 34 B7R0.5 CCOC(=O)C(N)=O E60589 [1,0,0,0,0,0|2,0,0]=3 35 B7R0.5 CCOC(=O)C(N)=S E15645 [1,0,0,0,0,0|2,1,0]=4 36 B7R0.5 CCOC(=O)[C@@H](C)N A39194 [1,0,0,0,0,0|2,0,1]=4 37 B7R0.5 CCOC(=O)[C@@H](C)O E68607 [1,0,0,0,0,0|1,0,2]=4 38 B7R0.5 CCOC(=O)[C@H](C)F E41270 [1,0,0,0,0,0|2,0,1]=4 39 B7R0.5 CCOC(=O)[C@H](C)S E40385 [1,0,0,0,0,0|1,1,1]=4 40 B7R0.5 CC\C=C(/C)C(=O)O M41462 [1,0,0,0,0,0|2,0,1]=4 41 B9R0.7 CC(C)CC[C@@H](N)C(=O)O A43927 [0,1,0,0,0,0|2,0,1]=4 42 B9R0.8 CCCC[C@H](N)C(=O)OC M46518 [0,1,0,0,0,0|1,0,1]=3 43 B9R0.8 COC(=O)[C@@H](Br)CCCBr M41466 [0,1,0,0,0,0|2,0,1]=4 44 B9R0.8 CON(C)C(=O)CCCCl C41545 [0,1,0,0,0,0|2,0,1]=4 45 B9R0.13 CCCC[C@H](CC)C(=O)[O-] P46623 [0,1,0,0,0,0|2,0,1]=4 46 B9R0.47 C=C(C)C(=O)NCCCN A46499 [0,1,0,0,0,0|2,0,0]=3 47 B9R0.47 CCCCC[C@@H](N)C(=O)O A43920 [0,1,0,0,0,0|2,0,1]=4 48 B9R0.47 CCCCC[C@H](N)C(=O)O A43919 [0,1,0,0,0,0|2,0,1]=4 49 B9R0.47 CCCCC[C@H](N)C(=O)O A43921 [0,1,0,0,0,0|2,0,1]=4 50 B9R0.47 CCCCOC(=O)[C@H](C)N B43923 [0,1,0,0,0,0|1,0,1]=3 51 B9R0.47 NCCCC[C@@H](N)C(=O)O L64962 [0,1,0,0,0,0|2,0,1]=4 52 B9R0.47 NCCCC[C@H](N)C(N)=O D43569 [0,1,0,0,0,0|2,0,1]=4 53 B9R1.5 CN1CCCCCC1=O M39292 [0,0,0,1,0,0|2,0,0]=3 54 B9R1.5 CN1CCCNCC1=O M1178 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.5 CN1CCNCCC1=O M41536 [0,0,0,1,0,0|3,0,0]=4 56 B9R1.5 CN1CCNCCC1=O M43468 [0,0,0,1,0,0|3,0,0]=4 57 B9R1.5 N[C@@H]1CCCCNC1=O A43466 [0,0,0,1,0,0|2,0,1]=4 58 B9R1.5 N[C@H]1CCCCNC1=O A24830 [0,0,0,1,0,0|2,0,1]=4 59 B9R1.5 N[C@H]1CCCCNC1=O A43463 [0,0,0,1,0,0|2,0,1]=4 60 B9R1.6 CC(=O)C1CCCCC1 C25535 [0,0,0,1,0,0|1,0,1]=3 61 B9R1.6 CC(=O)C1CCNCC1 P69462 [0,0,0,1,0,0|2,0,1]=4 62 B9R1.6 CC(=O)C1CCOCC1 T11195 [0,0,0,1,0,0|2,0,1]=4 63 B9R1.6 CC(=O)N1CCNCC1 A67843 [0,0,0,1,0,0|3,0,0]=4 64 B9R1.6 O=C(O)C1=CCCCO1 D43311 [0,0,0,1,0,0|1,0,2]=4 65 B9R1.6 O=C(O)C1=COCCC1 D23573 [0,0,0,1,0,0|3,0,0]=4 66 B9R1.6 O=C(O)C1CCCCC1 C64950 [0,0,0,1,0,0|2,0,1]=4 67 B9R1.6 O=C(O)N1CCCCC1 P62582 [0,0,0,1,0,0|3,0,0]=4 68 B9R1.6 O=C(O)[C@@H]1CCCCN1 P43440 [0,0,0,1,0,0|2,0,1]=4 69 B9R1.6 O=C(O)[C@@H]1CCCCN1 P43443 [0,0,0,1,0,0|2,0,1]=4 70 B9R1.6 O=C(O)[C@@H]1CCCCO1 T31331 [0,0,0,1,0,0|1,0,2]=4 71 B9R1.6 O=C(O)[C@H]1CCCCN1 P28251 [0,0,0,1,0,0|2,0,1]=4 72 B9R1.23 CN1C[C@@H](CN)CC1=O A10326 [0,0,0,1,0,0|3,0,0]=4 73 B9R1.35 CC(=O)N1CC[C@@H](O)C1 A7835 [0,0,0,1,0,0|3,0,0]=4 74 B9R1.35 CC(=O)N1CC[C@H](N)C1 A14633 [0,0,0,1,0,0|3,0,0]=4 75 B9R1.35 CC(=O)N1CC[C@H](O)C1 H41507 [0,0,0,1,0,0|3,0,0]=4 76 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 M60259 [0,0,0,1,0,0|2,0,1]=4 77 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 M60278 [0,0,0,1,0,0|2,0,1]=4 78 B9R1.40 CC1(C)CCCOC1=O D63281 [0,0,0,1,0,0|2,0,1]=4 79 B9R1.40 CC1(C)CNCCC1=O D11692 [0,0,0,1,0,0|2,0,1]=4 80 B9R1.40 CC1(C)COCCC1=O D24609 [0,0,0,1,0,0|2,0,1]=4 81 B9R1.69 CN1CC[C@H](N)CC1=O A0206 [0,0,0,1,0,0|3,0,0]=4 82 B9R1.69 CN1CC[C@H](N)CC1=O M7462 [0,0,0,1,0,0|3,0,0]=4 83 B9R1.69 CN1C[C@@H](N)CCC1=O A0588 [0,0,0,1,0,0|3,0,0]=4 84 B9R1.69 CN1C[C@@H](N)CCC1=O A12740 [0,0,0,1,0,0|3,0,0]=4 85 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 D13688 [0,0,0,1,0,0|3,0,0]=4 86 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 D43469 [0,0,0,1,0,0|3,0,0]=4 87 B9R1.69 C[C@H]1CN(C)C(=O)CN1 D13682 [0,0,0,1,0,0|3,0,0]=4 88 B9R1.69 C[C@H]1CN(C)C(=O)CN1 D30098 [0,0,0,1,0,0|3,0,0]=4 89 B9R1.69 C[C@H]1CN(C)CCC1=O D23777 [0,0,0,1,0,0|2,0,1]=4 90 B9R1.110 CC(=O)N(C)C1CNC1 A1327 [0,0,0,1,0,0|3,0,0]=4 91 B9R1.110 CN(C)C(=O)C1CNC1 D1324 [0,0,0,1,0,0|3,0,0]=4 92 B9R1.110 N[C@@H](C(=O)O)C1CCC1 A12996 [0,0,0,1,0,0|2,0,1]=4 93 B9R1.110 N[C@H](C(=O)O)C1CCC1 A10555 [0,0,0,1,0,0|2,0,1]=4 94 B9R1.110 N[C@H](C(=O)O)C1CCC1 A12995 [0,0,0,1,0,0|2,0,1]=4 95 B9R1.112 N[C@@H](CC1CC1)C(=O)O A41508 [0,0,0,1,0,0|2,0,1]=4 96 B9R1.112 N[C@H](CC1CC1)C(=O)O C68587 [0,0,0,1,0,0|2,0,1]=4 97 B9R1.163 NC(=O)C1(N)CCCC1 A41537 [0,0,0,1,0,0|2,0,1]=4 98 B9R1.163 O=C(O)C1(F)CCCC1 F38406 [0,0,0,1,0,0|2,0,1]=4 99 B9R1.163 O=C(O)C1(O)CCCC1 H41472 [0,0,0,1,0,0|1,0,2]=4 100 B9R0.4 C=CCOC(=O)CC(C)=O A39287 [0,0,0,0,0,1|1,0,2]=4 101 B9R0.4 CC(=O)CC(=O)NCCO H41517 [0,0,0,0,0,1|2,0,0]=3 102 B6R0.1 CCOC(=O)OC E40254 [2,0,0,0,0,0|2,0,0]=4 103 B6R0.1 CNC(=O)CCN A40306 [2,0,0,0,0,0|2,0,0]=4 104 B6R0.1 COC(=O)CCBr M39155 [2,0,0,0,0,0|2,0,0]=4 105 B6R0.1 COC(=O)CCN M67902 [2,0,0,0,0,0|2,0,0]=4 106 B6R0.1 COC(=O)CCO M24551 [2,0,0,0,0,0|2,0,0]=4 107 B6R0.4 CC(=O)CCCCl C68599 [2,0,0,0,0,0|1,0,0]=3 108 B6R0.4 CC(=O)NCCN A68626 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.4 CC(=O)NCCO H68625 [2,0,0,0,0,0|2,0,0]=4 110 B6R0.4 CC(=O)OCCBr B67892 [2,0,0,0,0,0|2,0,0]=4 111 B6R0.4 CC(C)=CCCBr B0351 [2,0,0,0,0,0|2,0,0]=4 112 B6R0.4 CC(C)=CCC[Mg+] M31885 [2,0,0,0,0,0|2,0,0]=4 113 B6R0.4 CCCCC(=N)N P41343 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.4 CCCCC(=O)[O-] S38573 [2,0,0,0,0,0|0,0,1]=3 115 B6R0.4 CCCOC(N)=O P40264 [2,0,0,0,0,0|2,0,0]=4 116 B6R0.4 CNCCC(=O)O M40350 [2,0,0,0,0,0|1,0,1]=4 117 B6R0.4 COC=CC(C)=O M41222 [2,0,0,0,0,0|1,0,1]=4 118 B6R0.4 COCCC(=O)O M40255 [2,0,0,0,0,0|1,0,1]=4 119 B6R0.4 NCCCC(N)=O A40304 [2,0,0,0,0,0|2,0,0]=4 120 B6R0.4 O=C(O)CCCBr B39154 [2,0,0,0,0,0|1,0,1]=4 121 B6R0.4 O=C(O)CCCCl C40232 [2,0,0,0,0,0|1,0,1]=4 122 B6R0.6 CC=CCCCO H41548 [2,0,0,0,0,0|1,0,0]=3 123 B6R0.6 CCCCCNC M41618 [2,0,0,0,0,0|1,0,1]=4 124 B6R0.6 O=CCCCCCl C41277 [2,0,0,0,0,0|1,0,1]=4 125 B6R0.6 O=CCCCCO H32202 [2,0,0,0,0,0|1,0,1]=4 126 B6R0.3 CCC(=O)C(=O)[O-] S40297 [2,0,0,0,0,0|1,0,0]=3 127 B6R0.3 CCC(=O)N(C)C D67412 [2,0,0,0,0,0|2,0,0]=4 128 B6R0.3 CCN(C)C(C)=O E40404 [2,0,0,0,0,0|2,0,0]=4 129 B8R0.1 CCOC(=O)CCCBr B69333 [1,1,0,0,0,0|1,0,1]=4 130 B8R0.1 CCOC(=O)CCCI E31893 [1,1,0,0,0,0|1,0,1]=4 131 B8R0.1 CCOC(=O)CCCN E43487 [1,1,0,0,0,0|1,0,1]=4 132 B8R0.1 CCOC(=O)CCNC E41584 [1,1,0,0,0,0|1,0,1]=4 133 B8R0.1 CCOC(=O)CCSC E39202 [1,1,0,0,0,0|1,0,1]=4 134 B8R0.1 CCOCC(=O)OCC E41554 [1,1,0,0,0,0|1,0,1]=4 135 B8R0.3 CCC[C@@H](N)C(=O)OC M66692 [1,1,0,0,0,0|1,0,0]=3 136 B8R0.3 CCC[C@H](N)C(=O)OC M43489 [1,1,0,0,0,0|1,0,0]=3 137 B8R0.3 CCN[C@@H](C)C(=O)OC M32327 [1,1,0,0,0,0|2,0,0]=4 138 B8R0.3 COC[C@@H](N)C(=O)OC M38225 [1,1,0,0,0,0|2,0,0]=4 139 B8R0.6 CCCC=CC(=O)OC M43802 [1,1,0,0,0,0|1,0,1]=4 140 B8R0.6 CCCCCC(=O)CBr B43868 [1,1,0,0,0,0|1,0,1]=4 141 B8R0.6 CCCCNC(=O)CCl B41547 [1,1,0,0,0,0|1,0,1]=4 142 B8R0.6 CNCCCC(=O)OC M43486 [1,1,0,0,0,0|1,0,0]=3 143 B8R0.6 COC(=O)CCCCBr M41523 [1,1,0,0,0,0|1,0,0]=3 144 B8R0.6 COC(=O)CCCCCl M63406 [1,1,0,0,0,0|1,0,0]=3 145 B8R0.6 COC(=O)CCCCN M43490 [1,1,0,0,0,0|1,0,0]=3 146 B8R0.6 COC(=O)COCCCl M41275 [1,1,0,0,0,0|2,0,0]=4 147 B8R0.6 COCCCC(=O)OC M68350 [1,1,0,0,0,0|1,0,0]=3 148 B8R0.19 CCC(=O)CC(=O)CC H43801 [1,1,0,0,0,0|0,0,2]=4 149 B8R0.19 CCC(=O)CC(=O)OC M39036 [1,1,0,0,0,0|1,0,1]=4 150 B8R0.19 CC[C@H](N)CC(=O)OC M43495 [1,1,0,0,0,0|1,0,0]=3 151 B8R0.19 COC(=O)C[C@@H](O)CCl M41276 [1,1,0,0,0,0|2,0,0]=4 152 B8R0.5 CCC[C@H](N)CC(=O)O A43488 [1,1,0,0,0,0|1,0,1]=4 153 B8R0.5 CCC\C(C)=C\C(=O)O M62391 [1,1,0,0,0,0|1,0,1]=4 154 B8R0.7 O=C(O)CCCCCBr B67880 [1,1,0,0,0,0|1,0,1]=4 155 B8R0.7 O=C(O)CCCCCCl C41527 [1,1,0,0,0,0|1,0,1]=4 156 B8R0.7 O=C([O-])CCCCCO P41406 [1,1,0,0,0,0|1,0,1]=4 157 B8R0.21 CCCCOS(C)(=O)=O B69150 [1,1,0,0,0,0|2,0,0]=4 158 B8R0.28 CC(=O)CCC=C(C)C M68353 [1,1,0,0,0,0|1,0,1]=4 159 B8R0.23 C=C(C)C(=O)NC(C)C P43839 [1,1,0,0,0,0|2,0,0]=4 160 B8R0.23 CC(=O)C(=O)OC(C)C P65400 [1,1,0,0,0,0|1,0,0]=3 161 B10R0.18 C#CCCC(=O)CC(=O)OC M61281 [0,1,0,0,0,1|0,0,2]=4 162 B10R0.18 CCCCC(=O)CC(=O)OC M47093 [0,1,0,0,0,1|0,0,0]=2 163 B10R0.44 COC(=O)CC(=O)CC(C)=O M43730 [0,1,0,0,0,1|1,0,1]=4 164 B10R0.19 CCCCC(=O)C(=O)OCC E12153 [0,2,0,0,0,0|0,0,0]=2 165 B10R0.83 COC(=O)[C@H](N)CCCCN M46606 [0,2,0,0,0,0|1,0,1]=4 166 B8R1.1 NC[C@@H]1CNC(=O)C1 A15732 [1,0,0,1,0,0|2,0,0]=4 167 B8R1.1 NC[C@@H]1CNC(=O)C1 A27672 [1,0,0,1,0,0|2,0,0]=4 168 B8R1.1 NC[C@@H]1CNC(=O)C1 A7263 [1,0,0,1,0,0|2,0,0]=4 169 B8R1.1 NC[C@H]1CNC(=O)C1 A18478 [1,0,0,1,0,0|2,0,0]=4 170 B8R1.1 NC[C@H]1CNC(=O)C1 A27671 [1,0,0,1,0,0|2,0,0]=4 171 B8R1.1 O=C1C[C@H](CO)CN1 H14660 [1,0,0,1,0,0|2,0,0]=4 172 B8R1.2 O=CC1=CCCOC1 D43308 [1,0,0,1,0,0|2,0,0]=4 173 B8R1.2 O=CC1=COCCC1 D43307 [1,0,0,1,0,0|2,0,0]=4 174 B8R1.2 O=CN1CCCCC1 P68910 [1,0,0,1,0,0|2,0,0]=4 175 B8R1.3 CC1CCC(=O)CC1 M39288 [1,0,0,1,0,0|0,0,1]=3 176 B8R1.3 CN1CCC(=O)CC1 M28326 [1,0,0,1,0,0|1,0,1]=4 177 B8R1.3 C[C@@H]1CNC(=O)CN1 M29571 [1,0,0,1,0,0|2,0,0]=4 178 B8R1.3 C[C@H]1CCC(=O)NC1 P23074 [1,0,0,1,0,0|1,0,0]=3 179 B8R1.3 C[C@H]1CNC(=O)CN1 M17917 [1,0,0,1,0,0|2,0,0]=4 180 B8R1.3 NC1CCC(=O)CC1 A38581 [1,0,0,1,0,0|1,0,1]=4 181 B8R1.3 N[C@H]1CCC(=O)NC1 A0587 [1,0,0,1,0,0|2,0,0]=4 182 B8R1.3 O=C1CCC(O)CC1 H18838 [1,0,0,1,0,0|1,0,1]=4 183 B8R1.3 O=C1CC[C@H](O)CN1 H22093 [1,0,0,1,0,0|2,0,0]=4 184 B8R1.5 CN1CCNCC1=O M12652 [1,0,0,1,0,0|2,0,0]=4 185 B8R1.5 CN1CCNCC1=O M4395 [1,0,0,1,0,0|2,0,0]=4 186 B8R1.5 C[C@H]1CCCCC1=O M68370 [1,0,0,1,0,0|0,0,1]=3 187 B8R1.5 C[C@H]1CCCNC1=O P23372 [1,0,0,1,0,0|1,0,1]=4 188 B8R1.5 C[C@H]1CCNCC1=O M14887 [1,0,0,1,0,0|1,0,1]=4 189 B8R1.5 C[C@H]1CNCCC1=O M14880 [1,0,0,1,0,0|1,0,1]=4 190 B8R1.5 C[C@H]1CNCCC1=O M41497 [1,0,0,1,0,0|1,0,1]=4 191 B8R1.5 C[C@H]1COCCC1=O M11408 [1,0,0,1,0,0|1,0,1]=4 192 B8R1.5 NN1CCCCC1=O A41312 [1,0,0,1,0,0|2,0,0]=4 193 B8R1.5 N[C@H]1CCCCC1=O A63504 [1,0,0,1,0,0|1,0,1]=4 194 B8R1.5 O=C1CCCC=C1Br B3408 [1,0,0,1,0,0|1,0,1]=4 195 B8R1.5 O=C1CCCCC1=O C67839 [1,0,0,1,0,0|0,0,0]=2 196 B8R1.22 O=C1C=CCCCC1 C67890 [1,0,0,1,0,0|0,0,1]=3 197 B8R1.22 O=C1CCCNCC1 H12307 [1,0,0,1,0,0|1,0,1]=4 198 B8R1.22 O=C1CCOCCN1 X16165 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.22 O=C1CCSCCN1 T6235 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.22 O=C1CNCCCN1 D38834 [1,0,0,1,0,0|2,0,0]=4 201 B8R1.38 COC(=O)C1CNC1 M5857 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.38 COC(=O)C1COC1 M15764 [1,0,0,1,0,0|2,0,0]=4 203 B8R1.38 COC(=O)[C@@H]1CCN1 M11233 [1,0,0,1,0,0|2,0,0]=4 204 B8R1.38 COC(=O)[C@@H]1CCN1 M11611 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.38 COC(=O)[C@H]1CCN1 M11612 [1,0,0,1,0,0|2,0,0]=4 206 B8R1.38 NNC(=O)C1CCC1 C12362 [1,0,0,1,0,0|2,0,0]=4 207 B8R1.40 COC(=O)CC1CC1 M11217 [1,0,0,1,0,0|1,0,0]=3 208 B8R1.4 CN1CCCC(=O)C1 M13651 [1,0,0,1,0,0|1,0,1]=4 209 B8R1.4 CN1CCNC(=O)C1 M6975 [1,0,0,1,0,0|2,0,0]=4 210 B8R1.4 CN1CCOC(=O)C1 M41260 [1,0,0,1,0,0|2,0,0]=4 211 B8R1.4 C[C@@H]1CC(=O)CCN1 M10735 [1,0,0,1,0,0|1,0,1]=4 212 B8R1.4 C[C@@H]1CC(=O)CCO1 M11329 [1,0,0,1,0,0|1,0,1]=4 213 B8R1.4 C[C@H]1CC(=O)CCN1 M10734 [1,0,0,1,0,0|1,0,1]=4 214 B8R1.4 C[C@H]1CC(=O)CCN1 M19737 [1,0,0,1,0,0|1,0,1]=4 215 B8R1.4 C[C@H]1CC(=O)CCN1 M8156 [1,0,0,1,0,0|1,0,1]=4 216 B8R1.4 C[C@H]1CC(=O)CCO1 M11328 [1,0,0,1,0,0|1,0,1]=4 217 B8R1.4 C[C@H]1CC(=O)CCO1 M14197 [1,0,0,1,0,0|1,0,1]=4 218 B8R1.4 C[C@H]1CCCC(=O)N1 M23832 [1,0,0,1,0,0|1,0,1]=4 219 B8R1.4 C[C@H]1CCNC(=O)C1 M23793 [1,0,0,1,0,0|1,0,0]=3 220 B8R1.4 N[C@H]1CCNC(=O)C1 A0054 [1,0,0,1,0,0|2,0,0]=4 221 B8R1.4 N[C@H]1CCNC(=O)C1 A37105 [1,0,0,1,0,0|2,0,0]=4 222 B8R1.4 O=C1C[C@@H](O)CCN1 H38902 [1,0,0,1,0,0|2,0,0]=4 223 B8R1.4 O=C1C[C@@H](O)CCN1 H41262 [1,0,0,1,0,0|2,0,0]=4 224 B8R1.7 CC(=O)C1CCCC1 C69351 [1,0,0,1,0,0|0,0,1]=3 225 B8R1.7 O=C(O)C1=CCCC1 C43305 [1,0,0,1,0,0|1,0,1]=4 226 B8R1.7 O=C(O)C1CCCC1 C23144 [1,0,0,1,0,0|1,0,1]=4 227 B8R1.34 CC(=O)NC1CNC1 A1331 [1,0,0,1,0,0|2,0,0]=4 228 B8R1.34 CC(=O)OC1CNC1 A41259 [1,0,0,1,0,0|2,0,0]=4 229 B8R1.34 CC(=O)OC1CNC1 A43595 [1,0,0,1,0,0|2,0,0]=4 230 B8R1.34 CC(=O)SC1CNC1 T12525 [1,0,0,1,0,0|2,0,0]=4 231 B8R1.34 O=C(O)C=C1CCC1 C10691 [1,0,0,1,0,0|1,0,1]=4 232 B8R1.34 O=C(O)CC1CCC1 C24745 [1,0,0,1,0,0|1,0,1]=4 233 B8R1.35 O=C(O)\C=C\C1CC1 C29885 [1,0,0,1,0,0|1,0,1]=4 234 B8R1.54 O=C(O)C(=O)C1CC1 C41121 [1,0,0,1,0,0|1,0,0]=3 235 B10R1.266 CC(=O)CC(=O)C1CCC1 C6255 [0,0,0,1,0,1|0,0,0]=2 236 B10R1.23 CC(=O)N(C)[C@@H]1CCNC1 A13070 [0,1,0,1,0,0|2,0,0]=4 237 B10R1.23 CC(=O)N(C)[C@@H]1CCNC1 M27099 [0,1,0,1,0,0|2,0,0]=4 238 B10R1.23 CC(=O)N(C)[C@H]1CCNC1 A13071 [0,1,0,1,0,0|2,0,0]=4 239 B10R1.23 CC(=O)N(C)[C@H]1CCNC1 M31027 [0,1,0,1,0,0|2,0,0]=4 240 B10R1.23 CC(=O)N(C)[C@H]1CCNC1 N13069 [0,1,0,1,0,0|2,0,0]=4 241 B10R1.23 CN(C)C(=O)[C@@H]1CCCN1 D14239 [0,1,0,1,0,0|2,0,0]=4 242 B10R1.23 CN(C)C(=O)[C@H]1CCCN1 D14238 [0,1,0,1,0,0|2,0,0]=4 243 B10R1.275 O=C1CCCCC(O)=C1F F59968 [0,1,0,1,0,0|1,0,1]=4 244 B10R1.13 CC(=O)N1CCC(Cl)CC1 C38339 [0,1,0,1,0,0|2,0,0]=4 245 B10R1.13 CC(=O)N1CCC(N)CC1 A12231 [0,1,0,1,0,0|2,0,0]=4 246 B10R1.13 CC(=O)N1CCC(N)CC1 A12232 [0,1,0,1,0,0|2,0,0]=4 247 B10R1.13 CC(=O)N1CCC(O)CC1 H7831 [0,1,0,1,0,0|2,0,0]=4 248 B10R1.15 COC(=O)C1=CCCCC1 M47018 [0,1,0,1,0,0|1,0,0]=3 249 B10R1.15 COC(=O)C1=CCOCC1 D4955 [0,1,0,1,0,0|2,0,0]=4 250 B10R1.15 COC(=O)C1=CNCCC1 M29675 [0,1,0,1,0,0|2,0,0]=4 251 B10R1.15 COC(=O)C1=COCCC1 M43727 [0,1,0,1,0,0|2,0,0]=4 252 B10R1.15 COC(=O)[C@@H]1CCCCN1 M28387 [0,1,0,1,0,0|1,0,1]=4 253 B10R1.15 COC(=O)[C@@H]1CCCCN1 M39293 [0,1,0,1,0,0|1,0,1]=4 254 B10R1.15 COC(=O)[C@@H]1CCCCN1 M39425 [0,1,0,1,0,0|1,0,1]=4 255 B10R1.15 COC(=O)[C@@H]1CCCCO1 M43819 [0,1,0,1,0,0|0,0,2]=4 256 B10R1.15 NCC(=O)C1CCCCC1 A11156 [0,1,0,1,0,0|1,0,1]=4 257 B10R1.15 NCC(=O)N1CCCCC1 A46500 [0,1,0,1,0,0|2,0,0]=4 258 B10R1.29 CCCCN1CCCC1=O B68886 [0,1,0,1,0,0|2,0,0]=4 259 B10R1.176 CN1CC[C@H](CN)CC1=O A0719 [0,1,0,1,0,0|2,0,0]=4 260 B10R1.176 CN1CC[C@H](CN)CC1=O A20770 [0,1,0,1,0,0|2,0,0]=4 261 B10R1.176 CN1CC[C@H](CO)CC1=O H0356 [0,1,0,1,0,0|2,0,0]=4 262 B10R1.182 CON(C)C(=O)C1CCC1 M24689 [0,1,0,1,0,0|1,0,1]=4 263 B10R1.411 COC(=O)C1(N)CCCC1 M24481 [0,1,0,1,0,0|1,0,1]=4 264 B10R1.411 COC(=O)C1(O)CCCC1 M29915 [0,1,0,1,0,0|0,0,2]=4 265 B10R1.348 CC(=O)N1CCCNCC1 D43875 [0,1,0,1,0,0|2,0,0]=4 266 B10R1.113 CC(=O)N1CCN[C@@H](C)C1 M46501 [0,1,0,1,0,0|2,0,0]=4 267 B10R1.262 CCO[C@H]1CC(=O)C1(C)C E6179 [0,1,0,1,0,0|1,0,1]=4 268 B10R1.363 CC(=O)C1(C)CCOCC1 M26198 [0,1,0,1,0,0|1,0,1]=4 269 B10R2.178 O=C1CCC2CCC1N2 A14807 [0,0,0,2,0,0|1,0,1]=4 270 B10R2.178 O=C1CCC2CCC1N2 A60094 [0,0,0,2,0,0|1,0,1]=4 271 B10R2.485 O=C(CC1CC1)C2CC2 D29645 [0,0,0,2,0,0|1,0,1]=4