0 B8R1.7 CC(=O)C1=CC=CN1 HY-W012956 [0,0,0,0,0,0|1,0,0]=1 1 B8R1.7 O=C(O)C1=CC=CN1 HY-W001963 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.7 O=C(O)C1=CNN=C1 HY-W002065 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.7 O=C(O)C1=NN=CN1 HY-107870 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.7 O=[N+]([O-])C1=NC=CN1 HY-N0195 [0,0,0,0,0,0|4,0,0]=4 5 B7R1.1 O=CC1=CC=CN1 HY-77817 [1,0,0,0,0,0|1,0,0]=2 6 B7R1.1 O=CC1=COC=C1 HY-76224 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.11 COC(=O)C1=NNC=N1 HY-W007685 [0,1,0,0,0,0|3,0,0]=4 8 B9R1.35 CC1=CC(C(=O)O)=NN1 HY-33009 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.6 CC(=O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-W782153 [0,0,0,0,0,1|1,0,0]=2 10 B9R1.6 N=C(N)C1=CN=CC=C1 HY-W002264 [0,0,0,0,0,1|3,0,0]=4 11 B9R1.6 NC(=O)C1=NC=CN=C1 HY-B0271R [0,0,0,0,0,1|2,0,0]=3 12 B9R1.6 NC(=S)C1=NC=CN=C1 HY-W129661 [0,0,0,0,0,1|2,1,0]=4 13 B9R1.6 [13CH3]C(=O)C1=CC=CC=C1 HY-Y0989S3 [0,0,0,0,0,1|1,0,0]=2 14 B6R0.4 O=C(O)\C=C\CO HY-100982 [1,0,1,0,0,0|1,0,1]=4 15 B6R0.3 CC(=O)C(=O)O[Na] HY-W015913 [1,0,1,0,0,0|2,0,0]=4 16 B6R0.3 CC(=O)C(=O)O[Na] HY-W015913R [1,0,1,0,0,0|2,0,0]=4 17 B6R0.3 CC(=O)[13C](=O)O[Na] HY-Y0781S3 [1,0,1,0,0,0|2,0,0]=4 18 B6R0.3 C[13C](=O)C(=O)O[Na] HY-Y0781S [1,0,1,0,0,0|2,0,0]=4 19 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 HY-78700 [0,1,0,0,0,1|2,0,0]=4 20 B10R1.13 O=C(O)C1=CC=C(O)N=C1 HY-W001996R [0,1,0,0,0,1|2,0,0]=4 21 B10R1.13 O=C(O)[13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1 HY-Y0264S [0,1,0,0,0,1|2,0,0]=4 22 B10R1.13 O=[13C](O)C1=CC=C(O)C=C1 HY-Y0264S2 [0,1,0,0,0,1|2,0,0]=4 23 B10R1.15 CNC(=O)C1=NC=CC=C1 HY-Z4481 [0,1,0,0,0,1|1,0,0]=3 24 B10R1.15 COC(=O)C1=CC=CN=C1 HY-B1695 [0,1,0,0,0,1|1,0,0]=3 25 B10R1.15 COC(=O)C1=CC=NC=N1 HY-W043311 [0,1,0,0,0,1|1,0,0]=3 26 B10R1.15 O=C(CO)C1=CC=CC=C1 HY-W002198 [0,1,0,0,0,1|1,0,0]=3 27 B10R1.61 CC(=O)C1=CC=CC=C1C HY-W012658 [0,1,0,0,0,1|1,0,0]=3 28 B10R1.61 CC(=O)C1=CC=CC=C1N HY-I0501 [0,1,0,0,0,1|1,0,0]=3 29 B10R1.61 CC1=C([13C](=O)O)C=CC=C1 HY-41494S1 [0,1,0,0,0,1|2,0,0]=4 30 B10R1.61 O=C(O)C1=NC=CC=C1S HY-128923 [0,1,0,0,0,1|2,0,0]=4 31 B10R1.113 CN1C=CCC(C(N)=O)=C1 HY-124313 [0,1,0,0,0,1|2,0,0]=4 32 B10R1.113 C[N+]1=CC(C(=O)[O-])=CC=C1 HY-N0414 [0,1,0,0,0,1|2,0,0]=4 33 B10R1.113 C[N+]1=CC(C(=O)[O-])=CC=C1 HY-N0414R [0,1,0,0,0,1|2,0,0]=4 34 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 HY-W005983 [0,1,0,0,0,1|2,0,0]=4 35 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 HY-Y0188 [0,1,0,0,0,1|2,0,0]=4 36 B10R1.14 COC(=O)C1=CC(Br)=CN1 HY-W007392 [0,2,0,0,0,0|1,0,0]=3 37 B10R1.31 CC(=O)C1=NC=C(CO)N1 HY-139094 [0,2,0,0,0,0|2,0,0]=4