0 B7R0.6 C(C(=O)O)=CC(=O)O HY-W015883 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.6 CC(=O)CCC(=O)O HY-Y0839 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.6 CC(=O)NCC(=O)O HY-Y0069 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.6 CC(=O)NNC(C)=O HY-I0777 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.6 N=C(N)NCC(=O)O HY-W021448 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.6 NC(=O)\C=C/C(=O)O HY-128750 [0,0,0,0,0,0|3,0,0]=3 6 B7R0.6 O=C(O)C#CC(=O)O HY-W094710 [0,0,0,0,0,0|4,0,0]=4 7 B7R0.6 O=C(O)CCC(=O)O HY-N0420 [0,0,0,0,0,0|4,0,0]=4 8 B7R0.6 O=C(O)CCC(=O)O HY-N0420R [0,0,0,0,0,0|4,0,0]=4 9 B7R0.6 O=C(O)\C=C/C(=O)O HY-Y0367 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.6 O=C(O)\C=C\C(=O)O HY-107829 [0,0,0,0,0,0|4,0,0]=4 11 B7R0.6 O=C(O)\C=C\C(=O)O HY-W015883R [0,0,0,0,0,0|4,0,0]=4 12 B7R0.6 O=C([O-])CCC(=O)[O-] HY-W105775 [0,0,0,0,0,0|4,0,0]=4 13 B7R0.6 O=C([O-])\C=C\C(=O)[O-] HY-B1651 [0,0,0,0,0,0|4,0,0]=4 14 B7R0.6 O=[13C](O)CC[13C](=O)O HY-N0420S3 [0,0,0,0,0,0|4,0,0]=4 15 B6R0.4 O=CNCC(=O)O HY-128735 [1,0,0,0,0,0|2,0,1]=4 16 B8R0.9 NCC(=O)CCC(=O)O HY-N0305 [0,1,0,0,0,0|3,0,0]=4 17 B8R0.9 NCC(=O)CCC(=O)O HY-N0305R [0,1,0,0,0,0|3,0,0]=4 18 B8R0.9 NCC(=O)NCC(=O)O HY-D0889R [0,1,0,0,0,0|2,0,1]=4 19 B8R0.23 NC(=O)CC(N)C(=O)O HY-W017442 [0,1,0,0,0,0|3,0,0]=4 20 B8R0.23 NC(=O)C[C@@H](N)C(=O)O HY-W010378 [0,1,0,0,0,0|3,0,0]=4 21 B8R0.23 NC(=O)C[C@H](N)C(=O)O HY-N0667R [0,1,0,0,0,0|3,0,0]=4 22 B8R0.23 NC(=O)C[C@H](N)C(=O)O HY-W017443 [0,1,0,0,0,0|3,0,0]=4 23 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(=O)O HY-N0667S2 [0,1,0,0,0,0|3,0,0]=4 24 B8R1.3 NC1=NN=C(Cl)C=C1 HY-Y0141 [0,0,0,1,0,0|3,0,0]=4 25 B8R1.3 O=C1C=CC(=O)NN1 HY-59354 [0,0,0,1,0,0|2,0,0]=3 26 B6R0.2 N=C(N)NC(=N)N HY-121006 [0,0,0,0,1,0|2,0,1]=4 27 B6R0.2 O=C(O)[Ca]C(=O)O HY-Y0262D [0,0,0,0,1,0|3,0,0]=4 28 B6R0.2 O=C(O)[SnH2]C(=O)O HY-W105856 [0,0,0,0,1,0|3,0,0]=4 29 B6R0.2 O=C([O-])CC(=O)[O-] HY-W283726 [0,0,0,0,1,0|3,0,0]=4 30 B8R0.28 NC(=O)NCCC(=O)O HY-113285 [0,0,0,0,0,1|2,0,1]=4 31 B7R1.2 O=C1C=CC(=O)N1 HY-W007324 [1,0,0,1,0,0|2,0,0]=4 32 B7R1.2 O=C1CCC(=O)N1 HY-41877 [1,0,0,1,0,0|2,0,0]=4 33 B7R1.2 O=C1CSC(=O)N1 HY-59272 [1,0,0,1,0,0|2,0,0]=4 34 B7R1.3 N=C1N=NC=CN1 HY-W004843 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.69 CC1=C(N)NC(=O)N=C1 HY-W008091 [0,1,0,1,0,0|2,0,0]=4 36 B9R1.69 CC1=C(N)NC(=O)N=C1 HY-W008091R [0,1,0,1,0,0|2,0,0]=4 37 B9R1.69 CC1=NNC(=O)NC1=O HY-136559 [0,1,0,1,0,0|1,0,1]=4 38 B5R0.5 C=C(C)C(N)=O HY-W020027 [0,0,0,0,2,0|2,0,0]=4 39 B5R0.5 CC(=O)C(=O)O HY-Y0781 [0,0,0,0,2,0|2,0,0]=4 40 B5R0.5 CC(=O)C(=O)O HY-Y0781R [0,0,0,0,2,0|2,0,0]=4 41 B5R0.5 CC(=O)[13C](=O)O HY-Y0781S1 [0,0,0,0,2,0|2,0,0]=4 42 B5R0.5 NC(=O)C(=O)O HY-W013032 [0,0,0,0,2,0|1,0,0]=3 43 B5R0.5 NC(=S)C(N)=S HY-W010488 [0,0,0,0,2,0|0,2,0]=4 44 B5R0.5 O=C(O)C(=O)O HY-W041831 [0,0,0,0,2,0|2,0,0]=4 45 B5R0.5 O=C(O)C(=O)O HY-Y0262 [0,0,0,0,2,0|2,0,0]=4 46 B5R0.5 O=C(O)C(=O)O HY-Y0262A [0,0,0,0,2,0|2,0,0]=4 47 B5R0.5 O=C(O)C(=O)O HY-Y1297 [0,0,0,0,2,0|2,0,0]=4