0 B10R0.3 COCC(=O)NCCC(=O)O BBS-00021062 [0,0,0,0,0,0|2,0,0]=2 1 B9R0.1 CCC(=O)NCCC(=O)O BBS-00021059 [1,0,0,0,0,0|1,0,0]=2 2 B9R0.1 COC(=O)CCC[N+](=O)[O-] BBS-00029659 [1,0,0,0,0,0|2,0,1]=4 3 B9R0.2 CCCCCCCC(=O)O BBS-00038798 [1,0,0,0,0,0|0,0,1]=2 4 B9R0.2 CCCCCCCC(=O)[O-] BBS-00038781 [1,0,0,0,0,0|0,0,2]=3 5 B9R0.2 CCCCCCNC(N)=O BBS-00036211 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.172 O=C(O)CCNC1=NCCC1 BBS-00020678 [0,0,0,1,0,0|2,0,0]=3 7 B8R0.7 CC(=O)CCCCCN BBS-00027353 [2,0,0,0,0,0|2,0,0]=4 8 B8R0.7 CCCCCCC(=O)O BBS-00039013 [2,0,0,0,0,0|0,0,0]=2 9 B8R0.7 CCCCCNC(N)=O BBS-00036209 [2,0,0,0,0,0|2,0,0]=4 10 B8R0.7 N#CCCCCC(=O)O BBS-00032190 [2,0,0,0,0,0|1,0,1]=4 11 B8R0.7 NCCCCCC(=O)O BBS-00032678 [2,0,0,0,0,0|1,0,0]=3 12 B8R0.28 CN(C)CCCC(=O)O BBS-00027570 [2,0,0,0,0,0|2,0,0]=4 13 B8R0.28 NC(=O)NCCC(=O)O BBS-00025528 [2,0,0,0,0,0|2,0,0]=4 14 B10R0.59 COC(=O)CCCC(=O)OC BBS-00038761 [1,1,0,0,0,0|1,0,0]=3 15 B10R0.82 COC(=O)CC[C@H](N)C(=O)O BBS-00034125 [1,1,0,0,0,0|1,0,0]=3 16 B10R0.82 NNC(=O)CCC(N)C(=O)O BBS-00039193 [1,1,0,0,0,0|2,0,0]=4 17 B10R0.4 CCCCCCCCC(=O)O BBS-00038971 [1,1,0,0,0,0|0,0,1]=3 18 B10R0.74 CCCCCCCC(=O)NN BBS-00022508 [1,1,0,0,0,0|1,0,1]=4 19 B10R0.97 CN(C)CCCCCC(=O)O BBS-00034518 [1,1,0,0,0,0|1,0,1]=4 20 B10R0.26 COCC(=O)NC(C)C(=O)O BBS-00021027 [0,1,0,0,1,0|2,0,0]=4 21 B10R0.96 CC(C)NC(=O)NCC(=O)O BBS-00038115 [0,1,0,0,1,0|2,0,0]=4 22 B12R0.140 CC(C)(C)OC(=O)NCCC(=O)O BBS-00022958 [0,2,0,0,0,0|2,0,0]=4 23 B12R0.164 CCCN(CCC)CCCC(=O)O BBS-00028440 [0,2,0,0,0,0|2,0,0]=4 24 B12R0.76 CCOC(=O)C(C)CC(C)C(=O)O BBS-00029719 [0,2,0,0,0,0|1,0,0]=3 25 B12R0.285 CCOC(=O)CCCC(=O)OCC BBS-00039185 [0,2,0,0,0,0|1,0,0]=3 26 B12R0.285 CCOC(=O)CSCC(=O)OCC BBS-00028812 [0,2,0,0,0,0|2,0,0]=4 27 B10R1.13 O=C(O)C1CCC(F)CC1 BBS-00029415 [1,0,0,1,0,0|1,0,1]=4 28 B10R1.10 CCNC1=CC(=O)CCC1 BBS-00015395 [1,0,0,1,0,0|2,0,0]=4 29 B10R1.18 CC(=O)CC1CCCCC1 BBS-00032528 [1,0,0,1,0,0|1,0,1]=4 30 B10R1.18 O=C(O)CC1CCCCO1 BBS-00020991 [1,0,0,1,0,0|1,0,1]=4 31 B10R1.18 O=C(O)CC1CCOCC1 BBS-00017032 [1,0,0,1,0,0|1,0,1]=4 32 B10R1.18 O=C(O)CN1CCCCC1 BBS-00000322 [1,0,0,1,0,0|1,0,1]=4 33 B10R1.64 O=C(O)CC1CCCC1O BBS-00036932 [1,0,0,1,0,0|1,0,1]=4 34 B10R1.66 O=C(O)CCC1CCCO1 BBS-00024554 [1,0,0,1,0,0|1,0,0]=3 35 B10R1.66 O=C(O)CCN1CCCC1 BBS-00013344 [1,0,0,1,0,0|1,0,1]=4 36 B10R1.66 O=C(O)COC1CCCC1 BBS-00032584 [1,0,0,1,0,0|1,0,1]=4 37 B10R1.126 O=C(O)CCOCC1CC1 BBS-00021038 [1,0,0,1,0,0|1,0,1]=4 38 B10R1.186 O=C(NCCCO)C1CC1 BBS-00025108 [1,0,0,1,0,0|1,0,1]=4 39 B10R1.82 CC1CC(CCC(=O)O)C1 BBS-00032040 [0,0,0,1,1,0|1,0,1]=4 40 B10R1.93 CCCC1CC(C(=O)O)C1 BBS-00032062 [0,0,0,1,1,0|1,0,1]=4 41 B10R1.113 O=C(O)C1CCCC(F)C1 BBS-00030021 [0,0,0,1,1,0|1,0,1]=4 42 B10R1.113 O=C1CCCC(C(=O)O)C1 BBS-00029913 [0,0,0,1,1,0|0,0,0]=2 43 B12R1.17 CCOC(=O)C1CCNC(=O)C1 BBS-00029853 [0,0,0,1,0,1|2,0,0]=4 44 B12R1.226 CC1CCCC(OCC(=O)O)C1 BBS-00032868 [0,0,0,1,0,1|1,0,1]=4 45 B12R1.252 O=C(O)CCCN1CCOCC1 BBS-00032043 [0,1,0,1,0,0|2,0,0]=4 46 B12R1.3092 C[Si]1(C)CCCC(C(=O)O)CC1 BBS-00030078 [0,1,0,1,0,0|1,1,0]=4 47 B12R1.1357 O=C(O)CCNC(=O)C1CCC1 BBS-00033063 [0,1,0,1,0,0|1,0,0]=3 48 B12R1.895 CC1=NNC(=O)C1CCC(=O)O BBS-00002521 [0,1,0,1,0,0|1,0,1]=4 49 B12R1.895 O=C(O)CCN1C(=O)CCC1=O BBS-00011077 [0,1,0,1,0,0|1,0,1]=4 50 B12R2.2899 C=C1CC2CC(=O)CC(C1)C2 BBS-00016592 [0,0,0,2,0,0|2,0,0]=4 51 B8R0.9 COC(=O)CCC(=O)Cl BBS-00025939 [1,0,0,0,1,0|2,0,0]=4 52 B8R0.5 CCOC(=O)CC(C)=O BBS-00004335 [0,0,0,0,2,0|2,0,0]=4