0 B11R1.91 CC(=O)OCC1=CC=CC=C1 HY-N7124 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 HY-W012595 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.17 CCOCC1=CC=CC=C1 HY-W017613 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.17 N#C[Se]CC1=CC=CC=C1 HY-131991 [1,0,0,0,0,0|1,0,2]=4 4 B10R1.17 NNCCC1=CC=CC=C1 HY-B1018A [1,0,0,0,0,0|2,0,0]=3 5 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 HY-N1426 [0,1,0,0,0,0|2,0,0]=3 6 B12R1.21 CC(=O)NCC1=CC=C(Cl)N=C1 HY-136608 [0,1,0,0,0,0|2,0,0]=3 7 B12R1.21 NC(=O)\C=C\C1=CC=C(O)C=C1 HY-N1901 [0,1,0,0,0,0|1,0,1]=3 8 B12R1.21 O=C(O)\C=C/C1=CC=C(O)C=C1 HY-N0351A [0,1,0,0,0,0|2,0,1]=4 9 B12R1.27 NCC(=O)OCC1=CC=CC=C1 HY-W011200 [0,1,0,0,0,0|1,0,0]=2 10 B12R1.43 N[13C@@H]([13CH2][13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1)[13C](=O)O HY-N0215S10 [0,1,0,0,0,0|2,0,0]=3 11 B12R1.43 N[13CH](CC1=CC=CC=C1)C(=O)O HY-B1732S3 [0,1,0,0,0,0|2,0,0]=3 12 B12R1.43 N[C@@H]([13CH2]C1=CC=CC=C1)C(=O)O HY-N0215S7 [0,1,0,0,0,0|2,0,0]=3 13 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 HY-30220 [0,1,0,0,0,0|2,0,0]=3 14 B12R1.43 [15NH2][13C@H]([13CH2][13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1)[13C](=O)O HY-N0215S11 [0,1,0,0,0,0|2,0,0]=3 15 B12R1.43 [C@H](N)(CC1=CN=CC=C1)C(=O)O HY-W017150 [0,1,0,0,0,0|3,0,0]=4 16 B12R1.125 CC(N)CCC1=CC=CC=C1Cl HY-117059 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.226 N=C(N)NCC1=CC=CC(I)=C1 HY-129040A [0,1,0,0,0,0|1,0,0]=2 18 B12R1.891 [2H]C([2H])([2H])NCC1=CC=CC=C1 HY-W007426S [0,1,0,0,0,0|2,0,1]=4 19 B12R2.24 O=C1C=CC2=CC=CC=C2N1 HY-W005598 [0,0,0,1,0,0|1,0,1]=3 20 B12R2.24 O=C1C=CC2=CC=CC=C2O1 HY-N0709R [0,0,0,1,0,0|2,0,1]=4 21 B9R1.8 NCCC1=CC=CC=N1 HY-107565 [2,0,0,0,0,0|1,0,1]=4 22 B9R1.8 OCCC1=CC=CC=C1 HY-B1290R [2,0,0,0,0,0|0,0,2]=4 23 B9R1.8 [Y]OCC1=CC=CC=C1 HY-P1453A [2,0,0,0,0,0|2,0,0]=4 24 B11R1.17 O=C\C=C\C1=C(O)C=CC=C1 HY-N3149 [1,1,0,0,0,0|1,0,1]=4 25 B11R1.17 O=C\C=C\C1=C(O)C=CC=C1 HY-N3149A [1,1,0,0,0,0|1,0,1]=4 26 B11R1.40 CC(CC1=CC=CC=C1)NN HY-W224327A [1,1,0,0,0,0|2,0,0]=4 27 B11R1.20 CC(N)CC1=CC=C(O)C=C1 HY-B1098 [0,1,0,0,1,0|1,0,1]=4 28 B11R1.20 CC1=CC=C(CC(C)N)C=C1 HY-W417914 [0,1,0,0,1,0|1,0,1]=4 29 B11R1.20 [13CH3][13C](=O)[15NH]C1=CC=C(O)C=C1 HY-66005S4 [0,1,0,0,1,0|1,0,0]=3 30 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 HY-W015600R [0,1,0,0,1,0|1,0,0]=3 31 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 HY-W008015 [0,1,0,0,1,0|1,0,0]=3 32 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 HY-W016562R [0,1,0,0,0,1|1,0,1]=4 33 B13R1.348 [C@@H](N)(CC(=O)O)CC1=CC=CC=C1 HY-W012451 [0,1,0,0,0,1|2,0,0]=4 34 B13R1.351 N[C@@H](CSC1=CC=CC=C1)C(=O)O HY-W020826 [0,1,0,0,0,1|2,0,0]=4 35 B13R1.718 NNC(=S)N\N=C\C1=CC=CC=C1 HY-149922 [0,1,0,0,0,1|0,1,1]=4 36 B13R1.133 N[13C@@H](CC1=CC=C(O)C=C1)C(=O)O HY-N0473S4 [0,2,0,0,0,0|2,0,0]=4 37 B13R1.133 N[13C@@H]([13CH2][13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1)[13C](=O)O HY-N0473S3 [0,2,0,0,0,0|2,0,0]=4 38 B13R1.133 N[C@H](CC1=CC=C(I)C=C1)C(=O)O HY-W011472 [0,2,0,0,0,0|2,0,0]=4 39 B13R1.133 O=C(O)[C@@H](O)CC1=CC=C(O)C=C1 HY-136593 [0,2,0,0,0,0|2,0,0]=4 40 B13R1.133 [15NH2][13C@@H]([13CH2][13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1)[13C](=O)O HY-Y0123S [0,2,0,0,0,0|2,0,0]=4 41 B13R1.511 N=C(N)SCC1=CC=C(Cl)C(Cl)=C1 HY-118773 [0,2,0,0,0,0|2,0,0]=4 42 B13R1.135 O=C(CC1=CC=CC=C1)C(=O)O[Na] HY-W016203 [0,2,0,0,0,0|2,0,0]=4 43 B13R1.148 NC(CC1=CC=CC(Br)=C1)C(=O)O HY-W003225 [0,2,0,0,0,0|2,0,0]=4 44 B13R1.148 [C@H](N)(CC1=CC(Cl)=CC=C1)C(=O)O HY-W012487 [0,2,0,0,0,0|2,0,0]=4 45 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O HY-N2378 [0,2,0,0,0,0|2,0,0]=4 46 B13R1.152 N[C@H](C(=O)O)[C@H](O)C1=CC=CC=C1 HY-W142083 [0,2,0,0,0,0|2,0,0]=4 47 B13R1.202 [C@H](N)(CC1=CC=CC=C1C)C(=O)O HY-W016555 [0,2,0,0,0,0|2,0,0]=4 48 B13R1.418 NO[C@@H](CC1=CC=CC=C1)C(=O)O HY-134230 [0,2,0,0,0,0|2,0,0]=4 49 B13R1.418 O=C(O)\C(CC1=CC=CC=C1)=N/O HY-121687 [0,2,0,0,0,0|2,0,0]=4 50 B11R2.1 O=C1COC2=C1C=CC=C2 HY-W001165 [1,0,0,1,0,0|2,0,0]=4 51 B11R2.10 O=C1NC2=CC=CC=C2N1 HY-W008003 [0,0,0,1,1,0|0,0,0]=2 52 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 HY-W017851 [0,0,0,1,0,1|1,0,0]=3 53 B13R2.155 O=C1CCC2=C(C=C(F)C=C2)C1 HY-30051 [0,1,0,1,0,0|2,0,0]=4 54 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)N1 HY-Y1685 [0,1,0,1,0,0|1,0,1]=4 55 B9R1.6 CC(=O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-W782153 [0,0,0,0,2,0|1,0,0]=3 56 B9R1.6 N=C(N)C1=CN=CC=C1 HY-W002264 [0,0,0,0,2,0|2,0,0]=4 57 B9R1.6 NC(=O)C1=NC=CN=C1 HY-B0271R [0,0,0,0,2,0|2,0,0]=4 58 B9R1.6 [13CH3]C(=O)C1=CC=CC=C1 HY-Y0989S3 [0,0,0,0,2,0|1,0,0]=3