0 B11R2.1 O=C1COC2=C1C=CC=C2 HY-W001165 [0,0,0,0,0,0|2,0,0]=2 1 B10R2.7 C1=CC2=C(C=C1)NCC2 HY-Y0788 [1,0,0,0,0,0|2,0,0]=3 2 B12R2.18 N[C@H]1C2=C(C=CC=C2)C[C@H]1O HY-W002530 [0,1,0,0,0,0|2,0,1]=4 3 B12R2.612 CC1=C2C=CC(N)=CC2=NN1 HY-Z0471 [0,1,0,0,0,0|3,0,0]=4 4 B10R1.15 CNC(=O)C1=NC=CC=C1 HY-Z4481 [0,0,1,0,0,0|2,0,0]=3 5 B10R1.15 COC(=O)C1=CC=CN=C1 HY-B1695 [0,0,1,0,0,0|1,0,0]=2 6 B10R1.15 COC(=O)C1=CC=NC=N1 HY-W043311 [0,0,1,0,0,0|2,0,0]=3 7 B10R1.15 NNC(=S)C1=CC=CC=C1 HY-129943 [0,0,1,0,0,0|2,1,0]=4 8 B10R1.15 O=C(CO)C1=CC=CC=C1 HY-W002198 [0,0,1,0,0,0|2,0,0]=3 9 B10R1.17 CCOCC1=CC=CC=C1 HY-W017613 [0,0,1,0,0,0|1,0,1]=3 10 B10R1.17 N#C[Se]CC1=CC=CC=C1 HY-131991 [0,0,1,0,0,0|1,1,1]=4 11 B10R1.17 NNCCC1=CC=CC=C1 HY-B1018A [0,0,1,0,0,0|3,0,0]=4 12 B10R1.20 C=CC1=CC=CC=C1C=C HY-46846 [0,0,1,0,0,0|2,0,1]=4 13 B10R1.61 CC(=O)C1=CC=CC=C1C HY-W012658 [0,0,1,0,0,0|1,0,0]=2 14 B10R1.61 CC(=O)C1=CC=CC=C1N HY-I0501 [0,0,1,0,0,0|2,0,0]=3 15 B10R1.61 CC1=C([13C](=O)O)C=CC=C1 HY-41494S1 [0,0,1,0,0,0|0,0,0]=1 16 B10R1.61 O=C(O)C1=NC=CC=C1S HY-128923 [0,0,1,0,0,0|2,0,0]=3 17 B12R2.24 O=C1C=CC2=CC=CC=C2N1 HY-W005598 [0,0,0,0,0,1|1,0,1]=3 18 B12R2.24 O=C1C=CC2=CC=CC=C2O1 HY-N0709R [0,0,0,0,0,1|1,0,1]=3 19 B12R2.1081 O=C1NC=NC2=C1C=CC=C2 HY-W018800 [0,0,0,0,0,1|1,0,1]=3 20 B9R1.6 CC(=O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-W782153 [1,0,1,0,0,0|0,0,0]=2 21 B9R1.6 [13CH3]C(=O)C1=CC=CC=C1 HY-Y0989S3 [1,0,1,0,0,0|0,0,0]=2 22 B9R1.8 OCCC1=CC=CC=C1 HY-B1290R [1,0,1,0,0,0|0,0,2]=4 23 B9R1.8 [Y]OCC1=CC=CC=C1 HY-P1453A [1,0,1,0,0,0|1,0,0]=3 24 B9R1.15 CC1=C([13CH]=O)C=CC=C1 HY-Y0442S [1,0,1,0,0,0|0,0,0]=2 25 B11R1.22 NC1=CC=C(C(=O)O[K])C=C1 HY-B1008A [0,1,1,0,0,0|1,0,0]=3 26 B11R1.1 CCOCC1=CC=C(O)C=C1 HY-N1875 [0,1,1,0,0,0|1,0,1]=4 27 B11R1.17 O=C\C=C\C1=C(O)C=CC=C1 HY-N3149 [0,1,1,0,0,0|1,0,1]=4 28 B11R1.17 O=C\C=C\C1=C(O)C=CC=C1 HY-N3149A [0,1,1,0,0,0|1,0,1]=4 29 B11R1.28 BrCCOCC1=CC=CC=C1 HY-W007388 [0,1,1,0,0,0|1,0,1]=4 30 B11R1.91 CC(=O)OCC1=CC=CC=C1 HY-N7124 [0,1,1,0,0,0|0,0,0]=2 31 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 HY-W012595 [0,1,1,0,0,0|1,0,1]=4 32 B11R1.53 CCC1=CC=CC=C1C(N)=O HY-W412047 [0,1,1,0,0,0|1,0,0]=3 33 B11R1.53 CNC1=C(C(=O)O)C=CC=C1 HY-W040705 [0,1,1,0,0,0|2,0,0]=4 34 B11R1.53 O=CC1=CC=CC=C1[N+](=O)[O-] HY-W007454 [0,1,1,0,0,0|1,0,1]=4 35 B11R1.87 NC1=CC=CC=C1S(=O)(=O)O HY-W015302 [0,1,1,0,0,0|2,0,0]=4 36 B11R1.156 CC1=C(C(=O)O)C(O)=CC=C1 HY-W002751 [0,1,1,0,0,0|0,0,0]=2 37 B11R1.156 NC1=CC=CC(Cl)=C1C(=O)O HY-Y1132 [0,1,1,0,0,0|1,0,0]=3 38 B11R1.159 CC(=O)C1=CC=CC(O)=C1N HY-109690 [0,1,1,0,0,0|2,0,0]=4 39 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl HY-W002412 [0,1,1,0,0,0|1,0,0]=3 40 B11R1.159 O=C(O)C1=CC=CC(O)=C1O HY-Y0202R [0,1,1,0,0,0|1,0,0]=3 41 B13R2.155 O=C1C=CC2=CC=C(O)C=C2O1 HY-N0573R [0,1,0,0,0,1|1,0,1]=4 42 B13R2.155 O=C1CCC2=C(C=C(F)C=C2)C1 HY-30051 [0,1,0,0,0,1|1,0,0]=3 43 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)N1 HY-Y1685 [0,1,0,0,0,1|1,0,1]=4 44 B13R2.328 O=C1C=C(O)C2=CC=CC=C2O1 HY-N6856 [0,1,0,0,0,1|1,0,1]=4 45 B13R2.3683 O=C1C=CC2=CC(O)=CC=C2O1 HY-N6656 [0,1,0,0,0,1|1,0,1]=4 46 B13R2.342 O=C1NC=CC2=C1C=CC=C2O HY-W015422 [0,1,0,0,0,1|1,0,1]=4 47 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 HY-W015600R [0,0,1,0,0,1|2,0,0]=4