0 B8R0.9 NC(CCC(O)=O)C=C HY-15399 [0,0,0,0,0,0|0,0,0]=0 1 B8R0.9 NC(CCC(O)=O)C=C HY-B0033 [0,0,0,0,0,0|0,0,0]=0 2 B8R0.9 NCC(=O)CCC(O)=O AC050222 [0,0,0,0,0,0|2,0,2]=4 3 B8R0.9 NCC(=O)CCC(O)=O AC510831 [0,0,0,0,0,0|2,0,2]=4 4 B8R0.9 NCC(=O)CCC(O)=O HY-N0305 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.4 COCCCC(O)=O AC100091 [1,0,0,0,0,0|1,0,1]=3 6 B7R0.6 CN(C)CCC(O)=O AC511515 [1,0,0,0,0,0|2,0,1]=4 7 B9R0.7 CC(=O)OC[C@H](N)C(O)=O HY-101409 [0,1,0,0,0,0|3,0,0]=4 8 B9R0.7 NC(CCC(N)=O)C(O)=O HY-B1346 [0,1,0,0,0,0|2,0,0]=3 9 B9R0.7 N[C@@H](CCC(N)=O)C(O)=O HY-N0390 [0,1,0,0,0,0|2,0,0]=3 10 B9R0.7 N[C@H](CCC(N)=O)C(O)=O HY-100587 [0,1,0,0,0,0|2,0,0]=3 11 B9R0.7 N[C@H](CCC(O)=O)C(O)=O AC510929 [0,1,0,0,0,0|1,0,0]=2 12 B9R0.7 N[C@H](CCC(O)=O)C(O)=O HY-100805 [0,1,0,0,0,0|1,0,0]=2 13 B9R0.7 O[C@H](CCC([O-])=O)C([O-])=O HY-100542 [0,1,0,0,0,0|2,0,1]=4 14 B9R1.35 O[C@@H]1CN[C@H](C1)C(O)=O AC182277 [0,0,0,1,0,0|2,0,1]=4 15 B9R1.35 O[C@H]1CN[C@H](C1)C(O)=O AC020366 [0,0,0,1,0,0|2,0,1]=4 16 B7R0.2 CC[C@H](C)CC(O)=O AC181465 [0,0,0,0,1,0|1,0,2]=4 17 B6R0.4 CC(=O)CCCCl AC511746 [2,0,0,0,0,0|2,0,0]=4 18 B6R0.4 COCCC(O)=O AC100057 [2,0,0,0,0,0|1,0,1]=4 19 B6R0.4 CSCCC(O)=O HY-101401 [2,0,0,0,0,0|1,0,1]=4 20 B6R0.4 OC(=O)CCC#C AC510868 [2,0,0,0,0,0|0,0,2]=4 21 B6R0.4 OC(=O)CCC#N AC512077 [2,0,0,0,0,0|0,0,2]=4 22 B6R0.4 OC(=O)CCC=C AC511045 [2,0,0,0,0,0|0,0,0]=2 23 B6R0.4 OC(=O)CCCBr AC511629 [2,0,0,0,0,0|1,0,0]=3 24 B6R0.6 ClCCCCC=O AC511901 [2,0,0,0,0,0|1,0,1]=4 25 B6R0.6 OCCCCC=O AC511239 [2,0,0,0,0,0|1,0,1]=4 26 B8R0.7 NCCCCCC(O)=O AC510865 [1,1,0,0,0,0|0,0,2]=4 27 B8R0.7 NCCCCCC(O)=O HY-B0236 [1,1,0,0,0,0|0,0,2]=4 28 B8R0.7 OC(=O)CCCCCBr AC510767 [1,1,0,0,0,0|0,0,2]=4 29 B8R0.28 CC(=O)CCCC(O)=O AC180079 [1,1,0,0,0,0|0,0,1]=3 30 B8R0.28 CN(C)CCCC(O)=O AC130623 [1,1,0,0,0,0|1,0,1]=4 31 B8R0.23 CC(C)C[C@@H](N)C(O)=O AC180566 [1,1,0,0,0,0|1,0,1]=4 32 B8R0.23 CC(C)[C@@H](CC(=O)O)N LN01359931 [1,1,0,0,0,0|1,0,1]=4 33 B8R0.23 CC(C)[C@@H](CC(=O)O)N LN01364924 [1,1,0,0,0,0|1,0,1]=4 34 B8R0.23 CC(C)[C@H](CC(=O)O)N LN00009939 [1,1,0,0,0,0|1,0,1]=4 35 B8R0.23 CC(C)[C@H](CC(=O)O)N LN01366567 [1,1,0,0,0,0|1,0,1]=4 36 B8R0.29 OC(=O)CCC(F)(F)F AC510760 [1,1,0,0,0,0|2,0,0]=4 37 B10R0.43 OC(=O)CCC(F)(F)C(O)=O AC160417 [0,2,0,0,0,0|2,0,0]=4 38 B8R1.1 BrC[C@@H]1CCC(=O)N1 AC020723 [1,0,0,1,0,0|1,0,1]=4 39 B8R1.1 C=CC1COC(=O)C1 AC020673 [1,0,0,1,0,0|2,0,0]=4 40 B8R1.1 OCC1CCC(=O)N1 AC160496 [1,0,0,1,0,0|1,0,1]=4 41 B8R1.1 OC[C@@H]1CCC(=O)N1 AC020686 [1,0,0,1,0,0|1,0,1]=4 42 B8R1.1 OC[C@H]1CCC(=O)N1 AC170007 [1,0,0,1,0,0|1,0,1]=4 43 B8R1.3 NC1CCC(=O)CC1 AC511876 [1,0,0,1,0,0|0,0,2]=4 44 B8R1.4 O=C1CCCC(=O)C1 AC510798 [1,0,0,1,0,0|2,0,0]=4 45 B8R1.7 OC(=O)C1=CCCC1 AC120012 [1,0,0,1,0,0|0,0,2]=4 46 B8R1.7 OC(=O)C1CC=CC1 AC180693 [1,0,0,1,0,0|0,0,2]=4 47 B8R1.7 OC(=O)C1CCCC1 AC180019 [1,0,0,1,0,0|0,0,2]=4 48 B8R1.7 OC(=O)C1CCCC1 AC500306 [1,0,0,1,0,0|0,0,2]=4 49 B8R1.7 OC(=O)C1CCCO1 AC511285 [1,0,0,1,0,0|1,0,1]=4 50 B8R1.7 OC(=O)C1CCCS1 AC040081 [1,0,0,1,0,0|1,0,1]=4 51 B8R1.7 OC(=O)C1CCOC1 AC190250 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.7 OC(=O)[C@@H]1CCCO1 AC190278 [1,0,0,1,0,0|1,0,1]=4 53 B8R1.7 OC(=O)[C@@H]1CCNC1 AC182243 [1,0,0,1,0,0|1,0,1]=4 54 B8R1.7 OC(=O)[C@H]1CCNC1 AC182027 [1,0,0,1,0,0|1,0,1]=4 55 B8R1.34 OC(=O)CC1CCC1 AC050613 [1,0,0,1,0,0|0,0,2]=4 56 B8R1.23 OC(=O)C1CC(=C)C1 AC021200 [1,0,0,1,0,0|1,0,1]=4 57 B8R1.77 OC(=O)C1CC1(F)F AC040002 [1,0,0,1,0,0|2,0,0]=4 58 B10R1.66 OC(=O)CCC1=NC=CS1 AC181494 [0,1,0,1,0,0|0,0,2]=4 59 B10R1.66 OC(=O)CCN1C=CC=N1 AC190113 [0,1,0,1,0,0|1,0,1]=4 60 B10R1.66 OC(=O)CCN1C=CN=C1 AC181512 [0,1,0,1,0,0|1,0,1]=4 61 B6R0.2 C[C@@H](CC(=O)O)N LN01357699 [1,0,0,0,1,0|0,0,1]=3 62 B6R0.2 C[C@H](N)CC(O)=O AC130275 [1,0,0,0,1,0|0,0,1]=3 63 B6R0.3 CC[C@@H](N)C(O)=O AC180579 [0,0,0,0,2,0|0,0,2]=4 64 B6R0.3 CC[C@H](N)C(O)=O AC511519 [0,0,0,0,2,0|0,0,2]=4 65 B6R0.3 NC[C@H](N)C(O)=O AC511517 [0,0,0,0,2,0|1,0,1]=4 66 B6R0.3 N[C@H](CO)C(O)=O AC180073 [0,0,0,0,2,0|1,0,1]=4 67 B6R0.3 N[C@H](CS)C(O)=O AC180279 [0,0,0,0,2,0|1,0,1]=4