0 B7R0.6 CC(=O)CCC(C)=O BBS-00004255 [0,0,0,0,0,0|1,0,0]=1 1 B7R0.6 CC(=O)NCC(=O)O BBS-00027759 [0,0,0,0,0,0|1,0,0]=1 2 B7R0.6 CC(=O)NNC(N)=S BBS-00025622 [0,0,0,0,0,0|3,1,0]=4 3 B7R0.6 CC(C)CCC(=O)O BBS-00024968 [0,0,0,0,0,0|1,0,1]=2 4 B7R0.6 CC(C)CNC(N)=O BBS-00036210 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.6 CN(C)CCC(=O)O BBS-00016366 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.6 NC(=O)CNC(N)=S BBS-00028776 [0,0,0,0,0,0|3,1,0]=4 7 B7R0.6 O=C(O)CC[N+](=O)[O-] BBS-00039635 [0,0,0,0,0,0|2,0,0]=2 8 B6R0.4 COCCC(=N)N BBS-00021181 [1,0,0,0,0,0|3,0,0]=4 9 B6R0.4 NCCCC(=O)O BBS-00028541 [1,0,0,0,0,0|1,0,1]=3 10 B6R0.4 O=C(O)CCCBr BBS-00039490 [1,0,0,0,0,0|1,0,1]=3 11 B8R0.9 CC(=N)SCC(=O)CCl BBS-00025040 [0,1,0,0,0,0|3,0,0]=4 12 B8R0.9 COC(=O)CCC(=O)Cl BBS-00025939 [0,1,0,0,0,0|1,0,0]=2 13 B8R0.23 C=C(CC(=O)O)C(=O)O BBS-00028902 [0,1,0,0,0,0|1,0,1]=3 14 B8R0.23 C=C(NC(C)=O)C(=O)O BBS-00024555 [0,1,0,0,0,0|1,0,1]=3 15 B8R0.23 CC(C)CC(N)C(=O)O BBS-00027539 [0,1,0,0,0,0|1,0,1]=3 16 B8R0.23 CC(C)C[C@H](N)C(=O)O BBS-00039169 [0,1,0,0,0,0|1,0,1]=3 17 B8R0.23 NC(=O)CC(N)C(=O)O BBS-00028459 [0,1,0,0,0,0|1,0,0]=2 18 B8R0.23 NC(CC(=O)O)C(=O)O BBS-00028490 [0,1,0,0,0,0|1,0,0]=2 19 B8R0.23 N[C@@H](CC(=O)O)C(=O)O BBS-00039167 [0,1,0,0,0,0|1,0,0]=2 20 B8R0.23 O=C(O)CC(=O)C(=O)O BBS-00020829 [0,1,0,0,0,0|1,0,1]=3 21 B8R0.23 O=C(O)CC(S)C(=O)O BBS-00020845 [0,1,0,0,0,0|1,0,0]=2 22 B8R0.23 O=C([O-])CC(O)C(=O)[O-] BBS-00032492 [0,1,0,0,0,0|1,0,1]=3 23 B8R0.23 O=C([O-])CC(O)C(=O)[O-] BBS-00039204 [0,1,0,0,0,0|1,0,1]=3 24 B8R0.29 CC(C)(N)CCC(=O)O BBS-00026952 [0,1,0,0,0,0|1,0,1]=3 25 B8R0.29 CN(C)CCS(=O)(=O)O BBS-00034367 [0,1,0,0,0,0|3,0,0]=4 26 B8R0.29 CP(=O)(O)CCC(=O)O BBS-00036988 [0,1,0,0,0,0|1,0,0]=2 27 B8R0.29 CS(=O)(=O)NCC(=O)O BBS-00032866 [0,1,0,0,0,0|2,0,0]=3 28 B8R1.3 CC1=NNC(=O)CC1 BBS-00008246 [0,0,0,1,0,0|2,0,0]=3 29 B8R1.3 CC1CCC(=O)CC1 BBS-00038787 [0,0,0,1,0,0|2,0,1]=4 30 B8R1.3 O=C1CNC(=O)CN1 BBS-00016505 [0,0,0,1,0,0|2,0,0]=3 31 B8R1.23 CC1CC(C(=O)O)C1 BBS-00025082 [0,0,0,1,0,0|1,0,1]=3 32 B8R1.23 O=C1CC(C(=O)O)C1 BBS-00024091 [0,0,0,1,0,0|0,0,0]=1 33 B8R1.35 CC(=O)OCC1CO1 BBS-00012684 [0,0,0,1,0,0|2,0,1]=4 34 B8R1.51 CC1=CS(=O)(=O)CC1 BBS-00004853 [0,0,0,1,0,0|2,0,1]=4 35 B8R1.51 C[Si]1(C)CCC(=O)C1 BBS-00030055 [0,0,0,1,0,0|2,1,0]=4 36 B8R1.77 CC1(C)CC1C(=O)O BBS-00017197 [0,0,0,1,0,0|1,0,1]=3 37 B6R0.2 CC(=O)CC(C)C BBS-00028076 [0,0,0,0,1,0|2,0,1]=4 38 B6R0.2 CC(=O)NC(N)=S BBS-00032848 [0,0,0,0,1,0|2,1,0]=4 39 B6R0.2 CC(C)CC(N)=O BBS-00025732 [0,0,0,0,1,0|2,0,1]=4 40 B6R0.2 CC(N)CC(=O)O BBS-00020853 [0,0,0,0,1,0|1,0,1]=3 41 B6R0.2 CN(C)CC(=O)O BBS-00031818 [0,0,0,0,1,0|2,0,0]=3 42 B6R0.2 NC(=O)CC(N)=O BBS-00010699 [0,0,0,0,1,0|2,0,0]=3 43 B6R0.2 NC(=O)CC(N)=S BBS-00000150 [0,0,0,0,1,0|2,1,0]=4 44 B6R0.2 O=C(O)CC(=O)O BBS-00003780 [0,0,0,0,1,0|1,0,0]=2 45 B6R0.2 O=C([O-])C[N+](=O)[O-] BBS-00032645 [0,0,0,0,1,0|2,0,1]=4 46 B8R0.28 CC(C)=NNCC(=O)O BBS-00030109 [0,0,0,0,0,1|2,0,0]=3 47 B8R0.28 CC(C)NCCC(=O)O BBS-00022956 [0,0,0,0,0,1|1,0,1]=3 48 B8R0.28 CN(C)CCCC(=O)O BBS-00027570 [0,0,0,0,0,1|2,0,0]=3 49 B8R0.28 NC(=O)NCCC(=O)O BBS-00025528 [0,0,0,0,0,1|1,0,0]=2 50 B5R0.1 CC(=O)\C=C/[O-] BBS-00032493 [2,0,0,0,0,0|0,0,2]=4 51 B5R0.1 CC(N)CCO BBS-00017066 [2,0,0,0,0,0|1,0,1]=4 52 B5R0.1 CNCC(=O)O BBS-00022461 [2,0,0,0,0,0|1,0,0]=3 53 B5R0.1 CNCC(N)=O BBS-00031965 [2,0,0,0,0,0|2,0,0]=4 54 B5R0.1 NCCC(=O)O BBS-00028074 [2,0,0,0,0,0|1,0,0]=3 55 B5R0.1 NOCC(=O)O BBS-00039484 [2,0,0,0,0,0|2,0,0]=4 56 B5R0.1 O=C(O)CCS BBS-00038803 [2,0,0,0,0,0|0,1,0]=3 57 B7R0.2 NC[C@H](O)CC(=O)O BBS-00024845 [1,1,0,0,0,0|1,0,1]=4 58 B7R0.3 CNCC\C(N)=N\O BBS-00027371 [1,1,0,0,0,0|2,0,0]=4 59 B7R0.3 COC(=O)CN=C=O BBS-00029434 [1,1,0,0,0,0|1,0,1]=4 60 B7R0.3 COCC\C(N)=N\O BBS-00026454 [1,1,0,0,0,0|2,0,0]=4 61 B7R0.3 NNC(=O)CCCO BBS-00004637 [1,1,0,0,0,0|1,0,1]=4 62 B7R0.4 CCCCNC(N)=O BBS-00036312 [1,1,0,0,0,0|1,0,1]=4 63 B7R0.4 CNCCCC(=O)O BBS-00027557 [1,1,0,0,0,0|0,0,1]=3 64 B7R0.4 COCCCC(=O)O BBS-00025182 [1,1,0,0,0,0|0,0,1]=3 65 B7R0.4 NCCCCC(=O)O BBS-00027472 [1,1,0,0,0,0|0,0,1]=3 66 B7R0.5 CC(=O)C(C)CCO BBS-00023798 [1,1,0,0,0,0|0,0,1]=3 67 B7R0.5 CCCC(N)C(=O)O BBS-00028258 [1,1,0,0,0,0|0,0,1]=3 68 B7R0.5 CSC[C@H](N)C(=O)O BBS-00012287 [1,1,0,0,0,0|1,0,0]=3 69 B7R0.5 NCC[C@H](N)C(=O)O BBS-00029762 [1,1,0,0,0,0|1,0,1]=4 70 B7R0.16 CC(=O)C(Cl)C(C)=O BBS-00027736 [0,1,0,0,1,0|1,0,0]=3 71 B7R0.16 CC(C(N)=O)C(N)=O BBS-00023360 [0,1,0,0,1,0|2,0,0]=4 72 B7R0.16 CC(C)C(N)C(=O)O BBS-00028075 [0,1,0,0,1,0|1,0,1]=4 73 B7R0.16 CC(C)[C@H](N)C(=O)O BBS-00027540 [0,1,0,0,1,0|1,0,1]=4 74 B7R0.16 CC(O)C(N)C(=O)O BBS-00021069 [0,1,0,0,1,0|0,0,2]=4 75 B7R0.16 CC(O)C(O)C(=O)O BBS-00027358 [0,1,0,0,1,0|0,0,2]=4 76 B9R0.1 CCC(=O)NCCC(=O)O BBS-00021059 [0,1,0,0,0,1|0,0,0]=2 77 B9R0.1 COC(=O)CCC[N+](=O)[O-] BBS-00029659 [0,1,0,0,0,1|1,0,1]=4 78 B9R0.1 COC(=O)CCNC(C)C BBS-00024517 [0,1,0,0,0,1|1,0,1]=4 79 B9R0.7 CS(=O)CCC(N)C(=O)O BBS-00034064 [0,1,0,0,0,1|1,0,0]=3 80 B9R0.7 NC(CCC(=O)O)C(=O)O BBS-00028400 [0,1,0,0,0,1|1,0,0]=3 81 B9R0.7 O=C(O)CCC(=O)C(=O)O BBS-00028522 [0,1,0,0,0,1|1,0,0]=3 82 B9R0.53 NN(CC(=O)O)CC(=O)O BBS-00039032 [0,1,0,0,0,1|1,0,0]=3 83 B9R0.56 CS(=O)(=O)NCCC(=O)O BBS-00032680 [0,1,0,0,0,1|1,0,0]=3 84 B9R0.21 COC(=O)CCS(=O)(=O)Cl BBS-00009720 [0,2,0,0,0,0|1,0,1]=4 85 B9R0.23 COC(=O)C(N)CC(C)C BBS-00028346 [0,2,0,0,0,0|1,0,1]=4 86 B9R0.23 COC(=O)\C(O)=C\C(C)=O BBS-00030114 [0,2,0,0,0,0|0,0,2]=4 87 B9R0.24 COC(=O)CCC(=O)OC BBS-00004425 [0,2,0,0,0,0|0,0,0]=2 88 B9R0.24 NNC(=O)CCC(=O)NN BBS-00001037 [0,2,0,0,0,0|2,0,0]=4 89 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O BBS-00034097 [0,2,0,0,0,0|1,0,0]=3 90 B9R0.43 CCN(CC)CCC(=O)O BBS-00033026 [0,2,0,0,0,0|2,0,0]=4 91 B9R0.64 CCS(=O)(=O)NCC(=O)O BBS-00032737 [0,2,0,0,0,0|2,0,0]=4 92 B9R0.39 CC(=O)NC(CS)C(=O)O BBS-00028726 [0,2,0,0,0,0|1,0,0]=3 93 B9R0.57 NC(CS(=O)(=O)O)C(=O)O BBS-00028830 [0,2,0,0,0,0|2,0,0]=4 94 B9R0.79 NC(=O)C(O)C(O)C(=O)O BBS-00024093 [0,2,0,0,0,0|1,0,0]=3 95 B9R0.79 O=C(O)C(O)C(O)C(=O)O BBS-00039182 [0,2,0,0,0,0|1,0,0]=3 96 B7R1.2 NC1=CC(=O)CC1 BBS-00025192 [1,0,0,1,0,0|1,0,1]=4 97 B7R1.2 O=C1CCC(=O)N1 BBS-00004334 [1,0,0,1,0,0|1,0,0]=3 98 B7R1.2 O=C1CSC(=O)N1 BBS-00008833 [1,0,0,1,0,0|2,0,0]=4 99 B7R1.2 O=C1CSC(=O)[N-]1 BBS-00036528 [1,0,0,1,0,0|2,0,0]=4 100 B7R1.3 O=C1CCCCN1 BBS-00039482 [1,0,0,1,0,0|1,0,1]=4 101 B7R1.3 O=C1CCSCC1 BBS-00036766 [1,0,0,1,0,0|2,0,0]=4 102 B7R1.3 O=C1NCCCO1 BBS-00028287 [1,0,0,1,0,0|1,0,1]=4 103 B7R1.18 NC(=O)C1CCC1 BBS-00025117 [1,0,0,1,0,0|1,0,1]=4 104 B7R1.18 O=C(O)C1CNC1 BBS-00022024 [1,0,0,1,0,0|1,0,0]=3 105 B7R1.20 O=C(Cl)CC1CC1 BBS-00025311 [1,0,0,1,0,0|1,0,1]=4 106 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 BBS-00025214 [0,0,0,1,0,1|1,0,1]=4 107 B9R1.35 O=C(O)C1CC(O)CN1 BBS-00023374 [0,0,0,1,0,1|0,0,2]=4 108 B9R1.35 O=C1CC(C(=O)O)CN1 BBS-00024553 [0,0,0,1,0,1|0,0,0]=2 109 B9R1.35 O=C1NCC(C(=O)O)O1 BBS-00024565 [0,0,0,1,0,1|1,0,0]=3 110 B9R1.35 O=C1NC[C@@H](C(=O)O)N1 BBS-00036973 [0,0,0,1,0,1|1,0,0]=3 111 B9R1.82 COC(=O)N1CC(=O)C1 BBS-00036908 [0,1,0,1,0,0|1,0,0]=3 112 B9R1.95 O=NN1CC(C(=O)O)C1 BBS-00037048 [0,1,0,1,0,0|1,0,0]=3 113 B9R1.138 O=C1CCS(=O)(=O)C1Br BBS-00029346 [0,1,0,1,0,0|1,0,1]=4 114 B9R2.145 O=C(O)C12CC(C1)C2 BBS-00030008 [0,0,0,2,0,0|1,0,1]=4 115 B5R0.5 CC(N)C(=O)O BBS-00003820 [0,0,0,0,2,0|1,0,1]=4 116 B5R0.5 C[C@H](N)C(=O)O BBS-00039166 [0,0,0,0,2,0|1,0,1]=4 117 B9R0.55 CC(=O)NCCNC(C)=O BBS-00022217 [0,0,0,0,0,2|1,0,0]=3 118 B9R0.55 NC(=O)NCCCC(=O)O BBS-00012973 [0,0,0,0,0,2|1,0,0]=3