0 B6R0.1 CCC\C(N)=N\O BBS-00019744 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.1 CNC(C)CSC BBS-00032852 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 [NH3+]CCC(F)C[NH3+] BBS-00026129 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.1 CC(N)CCO BBS-00017066 [1,0,0,0,0,0|2,0,1]=4 4 B5R0.1 CNCC(=O)O BBS-00022461 [1,0,0,0,0,0|2,0,1]=4 5 B5R0.1 COCC(C)N BBS-00028799 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.1 CSCC(C)N BBS-00032559 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.1 NCCC(=O)O BBS-00028074 [1,0,0,0,0,0|2,0,1]=4 8 B5R0.1 O=C(O)CCS BBS-00038803 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.2 C#CCNCC BBS-00016656 [1,0,0,0,0,0|1,0,2]=4 10 B5R0.2 C=CCN=C=O BBS-00026322 [1,0,0,0,0,0|2,0,1]=4 11 B5R0.2 C=CCN=C=S BBS-00024237 [1,0,0,0,0,0|2,0,1]=4 12 B5R0.2 CCCCCBr BBS-00028412 [1,0,0,0,0,0|1,0,1]=3 13 B5R0.2 CCCCON BBS-00029329 [1,0,0,0,0,0|2,0,0]=3 14 B5R0.2 CCCN=C=O BBS-00020505 [1,0,0,0,0,0|2,0,1]=4 15 B5R0.2 CCSCCO BBS-00015661 [1,0,0,0,0,0|2,0,1]=4 16 B5R0.2 COCCCN BBS-00028319 [1,0,0,0,0,0|2,0,1]=4 17 B5R0.2 COCCNN BBS-00024829 [1,0,0,0,0,0|3,0,0]=4 18 B5R0.2 COCCNN BBS-00032972 [1,0,0,0,0,0|3,0,0]=4 19 B5R0.2 OCCCCCl BBS-00028970 [1,0,0,0,0,0|2,0,1]=4 20 B5R0.3 C(=O)C(O)CO BBS-00029374 [1,0,0,0,0,0|2,0,0]=3 21 B5R0.3 C=CC(=O)OC BBS-00004387 [1,0,0,0,0,0|1,0,2]=4 22 B5R0.3 CCC(C)NN BBS-00032568 [1,0,0,0,0,0|3,0,0]=4 23 B5R0.3 CCC(N)CN BBS-00027091 [1,0,0,0,0,0|2,0,1]=4 24 B7R0.2 CN(C)CC(O)CN BBS-00021119 [0,1,0,0,0,0|2,0,1]=4 25 B7R0.3 CCCCC(N)C#N BBS-00018015 [0,1,0,0,0,0|2,0,1]=4 26 B7R0.5 CC(=O)C(C)CCO BBS-00023798 [0,1,0,0,0,0|2,0,1]=4 27 B7R0.5 CCCC(N)C(=O)O BBS-00028258 [0,1,0,0,0,0|2,0,0]=3 28 B7R0.5 CSC[C@H](N)C(=O)O BBS-00012287 [0,1,0,0,0,0|3,0,0]=4 29 B7R0.5 NCC[C@H](N)C(=O)O BBS-00029762 [0,1,0,0,0,0|3,0,0]=4 30 B7R0.10 OC(CS)C(O)CS BBS-00028966 [0,1,0,0,0,0|2,0,1]=4 31 B7R1.1 BrCC1CCCC1 BBS-00022002 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.1 BrCC1CCCO1 BBS-00028105 [0,0,0,1,0,0|1,0,1]=3 33 B7R1.1 ClCC1CCCO1 BBS-00003854 [0,0,0,1,0,0|1,0,1]=3 34 B7R1.1 NCC1CCCC1 BBS-00024973 [0,0,0,1,0,0|2,0,1]=4 35 B7R1.1 NCC1CCCO1 BBS-00008019 [0,0,0,1,0,0|1,0,1]=3 36 B7R1.1 NNC1CCCC1 BBS-00024826 [0,0,0,1,0,0|3,0,0]=4 37 B7R1.1 OCC1CCCC1 BBS-00024959 [0,0,0,1,0,0|2,0,1]=4 38 B7R1.3 CC1CCCCN1 BBS-00003594 [0,0,0,1,0,0|2,0,1]=4 39 B7R1.3 NC1CCCCC1 BBS-00003664 [0,0,0,1,0,0|1,0,2]=4 40 B7R1.3 O=C1C=COCC1 BBS-00032488 [0,0,0,1,0,0|1,0,2]=4 41 B7R1.3 OC1CCOCC1 BBS-00017028 [0,0,0,1,0,0|1,0,2]=4 42 B7R1.3 OC1COCOC1 BBS-00028828 [0,0,0,1,0,0|2,0,1]=4 43 B7R1.4 NC1CCCC1=O BBS-00029499 [0,0,0,1,0,0|2,0,0]=3 44 B7R1.4 NC1CCCC1=O BBS-00033202 [0,0,0,1,0,0|2,0,0]=3 45 B7R1.4 NC1CCSC1=O BBS-00038427 [0,0,0,1,0,0|3,0,0]=4 46 B7R1.4 NN1CCCC1=O BBS-00028647 [0,0,0,1,0,0|3,0,0]=4 47 B7R1.4 N[C@@H]1CCC[C@H]1O BBS-00024811 [0,0,0,1,0,0|1,0,1]=3 48 B7R1.4 O=C1NCCC1Br BBS-00032717 [0,0,0,1,0,0|3,0,0]=4 49 B7R1.4 O=C1OCCC1Br BBS-00015213 [0,0,0,1,0,0|3,0,0]=4 50 B7R1.5 CCCC1CC1N BBS-00020971 [0,0,0,1,0,0|2,0,1]=4 51 B7R1.10 CC1CC(CBr)C1 BBS-00025284 [0,0,0,1,0,0|2,0,1]=4 52 B7R1.10 CC1CC(CO)C1 BBS-00025280 [0,0,0,1,0,0|2,0,1]=4 53 B7R1.22 CC(NN)C1CC1 BBS-00024835 [0,0,0,1,0,0|3,0,0]=4 54 B7R1.22 CC(NN)C1CC1 BBS-00032820 [0,0,0,1,0,0|3,0,0]=4 55 B4R0.1 C=CC(C)=O BBS-00028059 [2,0,0,0,0,0|0,0,2]=4 56 B4R0.2 CCCNN BBS-00032546 [2,0,0,0,0,0|2,0,0]=4 57 B4R0.2 CNCCI BBS-00032731 [2,0,0,0,0,0|2,0,0]=4 58 B4R0.2 NCCCN BBS-00004281 [2,0,0,0,0,0|2,0,0]=4 59 B4R0.2 NCCCS BBS-00016508 [2,0,0,0,0,0|1,1,0]=4 60 B4R0.2 OCCCO BBS-00004418 [2,0,0,0,0,0|1,0,0]=3 61 B6R0.2 CC(N)CC(=O)O BBS-00020853 [1,1,0,0,0,0|1,0,1]=4 62 B6R0.2 CC(O)CC(C)S BBS-00029294 [1,1,0,0,0,0|0,0,1]=3 63 B6R0.3 CCC(N)C(=O)O BBS-00028679 [1,1,0,0,0,0|1,0,1]=4 64 B6R0.3 CCC(O)C(C)Br BBS-00033232 [1,1,0,0,0,0|1,0,1]=4 65 B6R0.4 NCCCC(=O)O BBS-00028541 [1,1,0,0,0,0|1,0,1]=4 66 B6R0.4 O=C(O)CCCBr BBS-00039490 [1,1,0,0,0,0|1,0,1]=4 67 B6R0.6 C#CCNCCC BBS-00016655 [1,1,0,0,0,0|0,0,2]=4 68 B6R0.6 C(C)=CCCCC BBS-00038760 [1,1,0,0,0,0|0,0,0]=2 69 B6R0.6 CCCCCCBr BBS-00028410 [1,1,0,0,0,0|0,0,2]=4 70 B6R0.6 CCCCCCN BBS-00038930 [1,1,0,0,0,0|0,0,2]=4 71 B6R0.6 CCCCN=C=O BBS-00004256 [1,1,0,0,0,0|1,0,1]=4 72 B6R0.6 CCOCCCN BBS-00016502 [1,1,0,0,0,0|1,0,1]=4 73 B6R0.6 CCOCCCO BBS-00022005 [1,1,0,0,0,0|1,0,1]=4 74 B6R0.6 CC\C=C\CCC BBS-00038759 [1,1,0,0,0,0|0,0,2]=4 75 B8R0.2 CCC(C)C(N)C(=O)O BBS-00028939 [0,2,0,0,0,0|2,0,0]=4 76 B8R0.2 CCC(C)[C@H](N)C(=O)O BBS-00038982 [0,2,0,0,0,0|2,0,0]=4 77 B8R0.23 CC(C)CC(N)C(=O)O BBS-00027539 [0,2,0,0,0,0|2,0,0]=4 78 B8R0.23 CC(C)C[C@H](N)C(=O)O BBS-00039169 [0,2,0,0,0,0|2,0,0]=4 79 B8R0.8 CCCCC(N)C(=O)O BBS-00028478 [0,2,0,0,0,0|2,0,0]=4 80 B8R0.8 CSCC[C@H](N)C(=O)O BBS-00028072 [0,2,0,0,0,0|2,0,0]=4 81 B8R0.8 NCCCC(N)C(=O)O BBS-00028696 [0,2,0,0,0,0|2,0,0]=4 82 B8R0.12 CCCC(C)(N)C(=O)O BBS-00022496 [0,2,0,0,0,0|2,0,0]=4 83 B6R1.2 NC1CCCC1 BBS-00003621 [1,0,0,1,0,0|1,0,1]=4 84 B6R1.2 OC1CCNC1 BBS-00033264 [1,0,0,1,0,0|1,0,1]=4 85 B6R1.8 CCC1OC1C BBS-00033237 [1,0,0,1,0,0|0,0,1]=3 86 B6R1.1 C1=COCOC1 BBS-00037150 [1,0,0,1,0,0|2,0,0]=4 87 B6R1.6 BrCC1CCC1 BBS-00021122 [1,0,0,1,0,0|1,0,1]=4 88 B6R1.6 CNC1CCC1 BBS-00032931 [1,0,0,1,0,0|1,0,1]=4 89 B6R1.6 NCC1CCC1 BBS-00021146 [1,0,0,1,0,0|1,0,1]=4 90 B6R1.6 NNC1CCC1 BBS-00024536 [1,0,0,1,0,0|2,0,0]=4 91 B6R1.6 NNC1CCC1 BBS-00032863 [1,0,0,1,0,0|2,0,0]=4 92 B8R1.4 CC1CCCC(O)C1 BBS-00028120 [0,1,0,1,0,0|0,0,2]=4 93 B8R1.4 NC1=CC(=O)CCC1 BBS-00015058 [0,1,0,1,0,0|0,0,2]=4 94 B8R1.4 O=C1C=C(Cl)CCC1 BBS-00015055 [0,1,0,1,0,0|0,0,2]=4 95 B8R1.4 OC1CCCC(O)C1 BBS-00029911 [0,1,0,1,0,0|0,0,2]=4 96 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O BBS-00020927 [0,1,0,1,0,0|2,0,0]=4 97 B8R1.2 ClCC1CCCCO1 BBS-00003971 [0,1,0,1,0,0|1,0,1]=4 98 B8R1.2 O=CC1CCOCC1 BBS-00017024 [0,1,0,1,0,0|2,0,0]=4 99 B8R1.3 NC1CCC(O)CC1 BBS-00020910 [0,1,0,1,0,0|0,0,2]=4 100 B8R1.5 NC1CCCCC1=O BBS-00031889 [0,1,0,1,0,0|1,0,1]=4 101 B8R1.5 NC1CCCCC1O BBS-00020912 [0,1,0,1,0,0|0,0,2]=4 102 B8R1.5 N[C@@H]1CCCC[C@H]1O BBS-00024810 [0,1,0,1,0,0|0,0,2]=4 103 B8R1.5 O=C1CCCC=C1O BBS-00026328 [0,1,0,1,0,0|0,0,2]=4 104 B8R1.5 [NH3+][C@H]1CCCC[C@H]1O BBS-00024547 [0,1,0,1,0,0|0,0,2]=4 105 B8R1.7 N=C(N)C1CCCC1 BBS-00032052 [0,1,0,1,0,0|2,0,0]=4 106 B8R1.7 O=C(O)C1CCCN1 BBS-00028435 [0,1,0,1,0,0|2,0,0]=4 107 B8R1.7 O=C(O)C1CCCO1 BBS-00038772 [0,1,0,1,0,0|1,0,0]=3 108 B8R1.7 O=C(O)[C@@H]1CCCN1 BBS-00039165 [0,1,0,1,0,0|2,0,0]=4 109 B8R1.23 CC1CC(C(=O)O)C1 BBS-00025082 [0,1,0,1,0,0|2,0,0]=4 110 B8R1.54 NC(=O)C(N)C1CC1 BBS-00032829 [0,1,0,1,0,0|2,0,0]=4 111 B8R1.8 CNCC1=NOC=C1 BBS-00032739 [0,1,0,1,0,0|1,0,1]=4 112 B8R1.8 CNCC1CCCO1 BBS-00031991 [0,1,0,1,0,0|0,0,2]=4 113 B8R1.8 NNCC1CCCO1 BBS-00024824 [0,1,0,1,0,0|1,0,1]=4 114 B8R1.8 S=C=NC1CCCO1 BBS-00028190 [0,1,0,1,0,0|1,0,1]=4 115 B8R1.11 N#CC1CCCC1=N BBS-00032392 [0,1,0,1,0,0|2,0,0]=4 116 B8R1.11 NC1CCCC1CO BBS-00032798 [0,1,0,1,0,0|1,0,1]=4 117 B8R1.11 NCC1CCCC1O BBS-00032845 [0,1,0,1,0,0|0,0,2]=4 118 B8R1.66 NCCC1(O)CCC1 BBS-00032964 [0,1,0,1,0,0|0,0,2]=4 119 B8R1.60 NCC1(CO)CCC1 BBS-00035786 [0,1,0,1,0,0|1,0,1]=4 120 B8R2.34 [C@@H]12CO[C@@H](CN1)C2 BBS-00023323 [0,0,0,2,0,0|1,0,1]=4 121 B8R2.25 C1CC2OC2CO1 BBS-00017852 [0,0,0,2,0,0|1,0,1]=4 122 B8R2.31 O=CC12CC(C1)C2 BBS-00030006 [0,0,0,2,0,0|2,0,0]=4