0 B8R0.8 CCCCC(Br)C(=O)O PHBB_SC-04834 [0,0,0,0,0,0|2,0,1]=3 1 B8R0.8 CCCCC(N)C(=O)O PHBB_SC-05891 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.8 CNCCC(=O)N(C)C PHBB_SC-03932 [0,0,0,0,0,0|3,0,0]=3 3 B8R0.8 CSCCC(N)C(=O)O PHBB_NC-00807 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.3 CCCCC(=O)CC PHBB_SC-05087 [1,0,0,0,0,0|0,0,1]=2 5 B7R0.3 CCCCC(=O)NN PHBB_SC-06626 [1,0,0,0,0,0|2,0,0]=3 6 B7R0.3 COC(=O)CCCCl PHBB_SC-05220 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.3 NNC(=O)CCCO PHBB_SC-02800 [1,0,0,0,0,0|3,0,0]=4 8 B7R0.4 CCCCCC(C)=O PHBB_SC-04832 [1,0,0,0,0,0|0,0,1]=2 9 B7R0.4 CCCCOC(=O)Cl PHBB_SC-04873 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.4 CCC\C=C/C(=O)O PHBB_NC-01804 [1,0,0,0,0,0|1,0,1]=3 11 B7R0.4 NCCCCC(=O)O PHBB_NC-02991 [1,0,0,0,0,0|2,0,1]=4 12 B7R0.5 C=C(C)C(=O)OCC PHBB_SC-04899 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.5 CCOC(=O)C(=O)Cl PHBB_SC-04645 [1,0,0,0,0,0|2,0,0]=3 14 B7R0.5 CCOC(=O)C(C)=O PHBB_SC-08023 [1,0,0,0,0,0|1,0,0]=2 15 B7R0.5 CCOC(=O)C(N)=O PHBB_SC-05129 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.5 [C@@H](C)(O)C(=O)OCC PHBB_NC-02006 [1,0,0,0,0,0|1,0,2]=4 17 B9R0.7 C=C(C)C(=O)OCC(C)C PHBB_NC-00708 [0,1,0,0,0,0|2,0,0]=3 18 B9R0.7 O=C(O)CCC(=O)C(=O)O PHBB_NC-02047 [0,1,0,0,0,0|2,0,1]=4 19 B9R0.8 COC(=O)[C@@H](N)CCSC PHBB_NC-01590 [0,1,0,0,0,0|2,0,1]=4 20 B9R0.13 CCCCC(CC)C(=O)Cl PHBB_SC-04924 [0,1,0,0,0,0|2,0,1]=4 21 B9R0.47 C=C(C)C(=O)OCCCC PHBB_SC-05059 [0,1,0,0,0,0|1,0,0]=2 22 B9R0.47 [C@@H](N)(CCCCN)C(=O)O PHBB_NC-01965 [0,1,0,0,0,0|2,0,1]=4 23 B9R0.47 [C@H](N)(CCNCC)C(=O)O PHBB_NC-01597 [0,1,0,0,0,0|2,0,1]=4 24 B9R1.5 O=C1NCCCCC1Br PHBB_SC-09745 [0,0,0,1,0,0|2,0,1]=4 25 B9R1.6 NC(=O)C1CCCCN1 PHBB_SC-08762 [0,0,0,1,0,0|2,0,1]=4 26 B9R1.6 O=C(O)C1CCCCN1 PHBB_SC-11307 [0,0,0,1,0,0|2,0,1]=4 27 B9R0.4 C=CCOC(=O)CC(C)=O PHBB_SC-04976 [0,0,0,0,0,1|1,0,2]=4 28 B9R0.4 CNCCC(=O)NC(C)C PHBB_SC-04329 [0,0,0,0,0,1|2,0,1]=4 29 B6R0.1 C=CC(=O)OCC PHBB_SC-05117 [2,0,0,0,0,0|1,0,1]=4 30 B6R0.1 CNCC(=O)NC PHBB_NC-02175 [2,0,0,0,0,0|2,0,0]=4 31 B6R0.1 COC(=O)CCBr PHBB_SC-11020 [2,0,0,0,0,0|2,0,0]=4 32 B6R0.1 COC(=O)CCN PHBB_NC-01592 [2,0,0,0,0,0|2,0,0]=4 33 B6R0.4 CC(=O)CCCCl PHBB_SC-05457 [2,0,0,0,0,0|1,0,0]=3 34 B6R0.4 CC(=O)NCCN PHBB_SC-10582 [2,0,0,0,0,0|2,0,0]=4 35 B6R0.4 CCCCC(=O)Cl PHBB_SC-04938 [2,0,0,0,0,0|1,0,0]=3 36 B6R0.4 CCCCC(C)=O PHBB_SC-04978 [2,0,0,0,0,0|0,0,0]=2 37 B6R0.4 CC\C=C\C(=O)O PHBB_NC-03021 [2,0,0,0,0,0|1,0,1]=4 38 B6R0.4 NCCCC(=O)O PHBB_NC-03308 [2,0,0,0,0,0|1,0,1]=4 39 B6R0.4 O=C(Cl)CCCCl PHBB_SC-04914 [2,0,0,0,0,0|2,0,0]=4 40 B6R0.6 CCCCN=C=O PHBB_SC-04717 [2,0,0,0,0,0|1,0,1]=4 41 B6R0.6 CCCCOC=O PHBB_SC-05072 [2,0,0,0,0,0|1,0,0]=3 42 B6R0.3 COC(=O)C(C)=O PHBB_SC-04860 [2,0,0,0,0,0|1,0,0]=3 43 B8R0.1 CCOC(=O)CCCCl PHBB_SC-05176 [1,1,0,0,0,0|1,0,1]=4 44 B8R0.6 CCCCCC(=O)CC PHBB_SC-04968 [1,1,0,0,0,0|0,0,1]=3 45 B8R0.9 COC(=O)CCC(C)=O PHBB_SC-05206 [1,1,0,0,0,0|1,0,1]=4 46 B8R0.11 CCCCC(C=O)CC PHBB_NC-03305 [1,1,0,0,0,0|0,0,2]=4 47 B8R0.19 CCC(=O)CC(C)CC PHBB_SC-04960 [1,1,0,0,0,0|0,0,1]=3 48 B8R0.7 CCCCCCC(C)=O PHBB_SC-04965 [1,1,0,0,0,0|0,0,1]=3 49 B8R0.7 CCCS\C=C/C(=O)[O-] PHBB_SC-04002 [1,1,0,0,0,0|1,0,1]=4 50 B8R0.7 O=C(O)CCCCCBr PHBB_SC-05192 [1,1,0,0,0,0|1,0,1]=4 51 B8R0.28 CC(=O)CCC=C(C)C PHBB_NC-00154 [1,1,0,0,0,0|1,0,1]=4 52 B10R0.6 COCCOC(=O)CC(C)=O PHBB_SC-04956 [0,1,0,0,0,1|1,0,0]=3 53 B10R0.32 CCOC(=O)C(=O)CC(C)=O PHBB_SC-02790 [0,1,0,0,0,1|1,0,1]=4 54 B10R0.82 C=C(C)C(=O)OCC(O)CCl PHBB_SC-04089 [0,2,0,0,0,0|2,0,0]=4 55 B10R0.83 [C@H](N)(CCCCN)C(=O)OC PHBB_NC-00617 [0,2,0,0,0,0|1,0,1]=4 56 B8R1.3 CC1CCC(=O)CC1 PHBB_SC-04943 [1,0,0,1,0,0|0,0,1]=3 57 B8R1.5 CC1CCCCC1=O PHBB_SC-04945 [1,0,0,1,0,0|0,0,1]=3 58 B8R1.5 O=C1CCCCC1Cl PHBB_SC-04048 [1,0,0,1,0,0|1,0,1]=4 59 B8R1.22 NC1=NCCCCC1 PHBB_SC-06290 [1,0,0,1,0,0|2,0,0]=4 60 B8R1.22 O=C1CCCCCN1 PHBB_SC-04792 [1,0,0,1,0,0|1,0,0]=3 61 B8R1.22 O=C1CCCCCO1 PHBB_SC-04881 [1,0,0,1,0,0|1,0,0]=3 62 B8R1.50 CC1CCC(=O)C1=O PHBB_NC-01795 [1,0,0,1,0,0|0,0,0]=2 63 B8R1.4 CC1CCCC(=O)C1 PHBB_SC-05010 [1,0,0,1,0,0|0,0,1]=3 64 B10R1.13 CC(=O)N1CCC(N)CC1 PHBB_SC-09299 [0,1,0,1,0,0|2,0,0]=4 65 B10R1.205 C=C(C)C(=O)OCC1CO1 PHBB_NC-00133 [0,1,0,1,0,0|2,0,0]=4 66 B10R1.15 CNC(=O)C1CCCCN1 PHBB_SC-08763 [0,1,0,1,0,0|1,0,1]=4