0 B14R2.781 CC(=O)C1=CC2=CC=CC=C2N=C1 4H56-1-0B1 [0,0,0,0,0,0|1,0,0]=1 1 B14R2.781 CC(=O)C1=CC=C2OCCOC2=C1 2H17-1-39 [0,0,0,0,0,0|2,0,2]=4 2 B14R2.781 CN(N)C1=NC2=CC=CC=C2N=C1 3H32-1-N7 [0,0,0,0,0,0|4,0,0]=4 3 B14R2.781 NC(=O)C1=CC2=CC=CC=C2C=C1 4648-1-3T [0,0,0,0,0,0|1,0,0]=1 4 B14R2.781 O=C(Cl)C1=CC2=NC=CN=C2C=C1 4H16-5-W3 [0,0,0,0,0,0|3,0,0]=3 5 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=C1 2621-1-97 [0,0,0,0,0,0|1,0,0]=1 6 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 4H21-1-70 [0,0,0,0,0,0|2,0,0]=2 7 B14R2.781 O=C(O)C1=CC2=CC=CC=C2N=C1 4H21-1-XB [0,0,0,0,0,0|2,0,0]=2 8 B14R2.781 O=C(O)C1=CC2=CC=CC=C2OC1 2H21-1-Y9 [0,0,0,0,0,0|2,0,1]=3 9 B14R2.781 O=C(O)C1=CC2=CC=CN=C2C=C1 4H21-1-Z4 [0,0,0,0,0,0|2,0,0]=2 10 B14R2.781 O=C(O)C1=CC2=CC=NC=C2C=C1 4H21-1-D1 [0,0,0,0,0,0|2,0,0]=2 11 B14R2.781 O=C(O)C1=CC2=CN=CC=C2C=C1 4H56-1-2J [0,0,0,0,0,0|2,0,0]=2 12 B14R2.781 O=C(O)C1=CC2=NC=CC=C2C=C1 P612-A-90 [0,0,0,0,0,0|2,0,0]=2 13 B14R2.781 O=C(O)C1=CC2=NC=CN=C2C=C1 4H21-1-V2 [0,0,0,0,0,0|3,0,0]=3 14 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=C1 4H21-1-E9 [0,0,0,0,0,0|2,0,0]=2 15 B14R2.781 O=C(O)C1=NC2=CC=CC=C2N=C1 4H21-1-XC [0,0,0,0,0,0|3,0,0]=3 16 B14R2.781 O=C(O)C1=NC2=CC=NC=C2C=C1 4H56-1-4C [0,0,0,0,0,0|3,0,0]=3 17 B14R2.781 O=C(O)C1=NC2=NC=CC=C2C=C1 4H56-1-2G [0,0,0,0,0,0|3,0,0]=3 18 B14R2.781 O=C(O)C1=NC=C2C=CC=CC2=C1 4H21-1-G5 [0,0,0,0,0,0|2,0,0]=2 19 B14R2.781 O=[N+]([O-])C1=CC2=CC=CN=C2C=C1 4H54-1-26 [0,0,0,0,0,0|3,0,0]=3 20 B14R2.781 O=[N+]([O-])C1=CC2=NC=CC=C2C=C1 4H54-1-LE [0,0,0,0,0,0|3,0,0]=3 21 B14R2.781 O=[N+]([O-])C1=CC2=NC=CN=C2C=C1 4H54-1-Q5 [0,0,0,0,0,0|4,0,0]=4 22 B14R2.781 OB(O)C1=CC2=CC=CC=C2C=C1 6660-1-Y8 [0,0,0,0,0,0|2,0,1]=3 23 B14R2.781 OB(O)C1=CC2=CC=CN=C2C=C1 P911-A-77 [0,0,0,0,0,0|3,0,1]=4 24 B14R2.781 OB(O)C1=CC2=CC=NC=C2C=C1 8H60-1-V0 [0,0,0,0,0,0|3,0,1]=4 25 B14R2.781 OB(O)C1=CC2=CN=CC=C2C=C1 8H60-1-J7 [0,0,0,0,0,0|3,0,1]=4 26 B14R2.781 OB(O)C1=CN=C2C=CC=CC2=C1 8H60-1-G0 [0,0,0,0,0,0|3,0,1]=4 27 B13R2.57 BrCC1=CC2=CC=CC=C2C=C1 1700-9-Z8 [1,0,0,0,0,0|1,0,1]=3 28 B13R2.57 BrCC1=CC2=CC=NC=C2C=C1 3H32-9-V3 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.57 BrCC1=CC2=CN=CC=C2C=C1 3H32-9-V5 [1,0,0,0,0,0|2,0,1]=4 30 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 3H32-9-U1 [1,0,0,0,0,0|2,0,1]=4 31 B13R2.57 C#CC1=CC2=CC=CC=C2C=C1 1900-1-Y2 [1,0,0,0,0,0|0,0,2]=3 32 B13R2.57 C=CC1=NC2=CC=CC=C2C=C1 3H32-1-4P [1,0,0,0,0,0|1,0,1]=3 33 B13R2.57 COC1=CC2=CC=CC=C2C=C1 2607-1-0R [1,0,0,0,0,0|1,0,0]=2 34 B13R2.57 COC1=CC2=CC=CN=C2C=C1 4H07-1-Y7 [1,0,0,0,0,0|2,0,0]=3 35 B13R2.57 COC1=CC2=CC=NC=C2C=C1 4656-1-Z9 [1,0,0,0,0,0|2,0,0]=3 36 B13R2.57 COC1=CC2=CN=CC=C2C=C1 4656-1-Z8 [1,0,0,0,0,0|2,0,0]=3 37 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 3H32-5-P7 [1,0,0,0,0,0|2,0,1]=4 38 B13R2.57 N#CC1=CC2=CC=CC=C2C=C1 3637-1-26 [1,0,0,0,0,0|1,0,1]=3 39 B13R2.57 N#CC1=CC2=CC=CC=C2N=C1 3H37-1-3W [1,0,0,0,0,0|2,0,1]=4 40 B13R2.57 N#CC1=CC2=CC=NC=C2C=C1 3H37-1-X0 [1,0,0,0,0,0|2,0,1]=4 41 B13R2.57 N#CC1=NC2=CC=CC=C2C=C1 3H37-1-Q6 [1,0,0,0,0,0|2,0,1]=4 42 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 3H30-5-U3 [1,0,0,0,0,0|2,0,1]=4 43 B13R2.57 NNC1=CC2=CC=CC=C2C=C1 3639-1-05 [1,0,0,0,0,0|2,0,0]=3 44 B13R2.57 O=CC1=CC2=CC=CC=C2C=C1 2615-1-61 [1,0,0,0,0,0|0,0,0]=1 45 B13R2.57 O=CC1=CC2=CC=CN=C2C=C1 4H15-1-V0 [1,0,0,0,0,0|1,0,0]=2 46 B13R2.57 O=CC1=CC=C2N=CC=NC2=C1 4H15-1-L8 [1,0,0,0,0,0|2,0,0]=3 47 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 4H15-1-0H [1,0,0,0,0,0|1,0,0]=2 48 B13R2.57 O=CC1=NC2=CC=CC=C2N=C1 4H15-1-G0 [1,0,0,0,0,0|2,0,0]=3 49 B13R2.57 O=CC1=NC=C2C=CC=CC2=C1 4H15-1-N7 [1,0,0,0,0,0|1,0,0]=2 50 B13R2.57 OCC1=CC2=CC=CC=C2C=C1 2601-1-11 [1,0,0,0,0,0|0,0,2]=3 51 B13R2.57 OCC1=CC2=CC=CN=C2C=C1 4H01-1-9B [1,0,0,0,0,0|1,0,2]=4 52 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 4H01-1-T3 [1,0,0,0,0,0|1,0,2]=4 53 B15R2.627 CC(=O)C1=C(O)C2=CC=CC=C2C=C1 2620-1-10 [0,1,0,0,0,0|0,0,0]=1 54 B15R2.627 CC1=C([N+](=O)[O-])C=NC2=CC=CC=C21 4H54-1-LT [0,1,0,0,0,0|3,0,0]=4 55 B15R2.627 O=C(O)C1=C(O)C2=CC=CC=C2C=C1 2629-1-X7 [0,1,0,0,0,0|1,0,0]=2 56 B15R2.627 O=C(O)C1=C(O)C2=NC=CC=C2C=C1 4H58-1-163 [0,1,0,0,0,0|2,0,0]=3 57 B15R2.627 O=[N+]([O-])C1=C(O)C2=CC=CC=C2C=C1 4654-1-V6 [0,1,0,0,0,0|2,0,0]=3 58 B15R2.984 CC(=O)C1=CC2=CC=CC=C2OC1=O 2H25-1-14 [0,1,0,0,0,0|1,0,0]=2 59 B15R2.984 CC1=NC2=CC=CC=C2C=C1C(=O)O 4H58-1-FX [0,1,0,0,0,0|2,0,0]=3 60 B15R2.984 CC1=NC2=CC=NC=C2C=C1C(=O)O 4H21-1-M6 [0,1,0,0,0,0|3,0,0]=4 61 B15R2.984 CC1=NC2=NC=CC=C2C=C1C(=O)O 4H21-1-M7 [0,1,0,0,0,0|3,0,0]=4 62 B15R2.984 NC1=CC2=CC=CC=C2C=C1C(=O)O 4657-1-67 [0,1,0,0,0,0|1,0,0]=2 63 B15R2.984 O=C(O)C1=CC2=CC=CC=C2C=C1O 2629-1-0P [0,1,0,0,0,0|1,0,0]=2 64 B15R2.984 O=C(O)C1=CC2=CC=CC=C2OC1=O 2H21-1-X3 [0,1,0,0,0,0|2,0,0]=3 65 B15R2.984 O=C(O)C1=NC2=CC=CC=C2N=C1Cl 4H21-5-0P [0,1,0,0,0,0|3,0,0]=4 66 B15R2.1601 COC(=O)C1=CC2=CC=CC=C2C=C1 2623-1-Z1 [0,1,0,0,0,0|0,0,0]=1 67 B15R2.1601 COC(=O)C1=CC2=CC=CC=C2C=N1 4H23-1-X1 [0,1,0,0,0,0|1,0,0]=2 68 B15R2.1601 COC(=O)C1=CC2=CC=CN=C2C=C1 4H23-1-P2 [0,1,0,0,0,0|1,0,0]=2 69 B15R2.1601 COC(=O)C1=CC2=NC=CN=C2C=C1 4H23-1-4T [0,1,0,0,0,0|2,0,0]=3 70 B15R2.1601 NNC(=O)C1=CC2=CC=CC=C2C=C1 4656-1-51 [0,1,0,0,0,0|1,0,0]=2 71 B15R2.1601 NNC(=O)C1=CC2=NC=CN=C2C=C1 4H48-1-YQ [0,1,0,0,0,0|3,0,0]=4 72 B15R2.4441 F[B-](F)(F)C1=CC2=CC=CC=C2C=C1 6660-3-U4 [0,1,0,0,0,0|3,0,0]=4 73 B15R2.4441 O=S(=O)(Cl)C1=CC2=CC=CC=C2C=C1 6662-5-07 [0,1,0,0,0,0|2,0,0]=3 74 B15R2.4441 O=S(=O)(O)C1=CC2=CC=CC=C2C=C1 6664-1-02 [0,1,0,0,0,0|2,0,0]=3 75 B15R2.4441 O=S(=O)([O-])C1=CC2=CC=CC=C2C=C1 6664-1-Y0 [0,1,0,0,0,0|2,0,0]=3 76 B15R2.7174 O=C(O)C1=CC2=C(C=CC(Cl)=C2)OC1 2H21-1-Y8 [0,1,0,0,0,0|2,0,1]=4 77 B15R2.7174 O=C(O)C1=CC2=CC(Br)=CC=C2OC1 2H21-9-0A [0,1,0,0,0,0|2,0,1]=4 78 B15R2.7174 O=C(O)C1=NC2=CC(Br)=CC=C2C=C1 4H21-9-1B [0,1,0,0,0,0|2,0,0]=3 79 B15R2.7180 CC1=NC2=CC=C(C(=O)O)C=C2C=C1 4H21-1-9W [0,1,0,0,0,0|2,0,0]=3 80 B15R2.7180 CC1=NC2=CC=C([N+](=O)[O-])C=C2C=C1 4H55-1-Y7 [0,1,0,0,0,0|3,0,0]=4 81 B15R2.7180 O=C(O)C1=CC2=CC=C(O)C=C2C=C1 2629-1-41 [0,1,0,0,0,0|1,0,0]=2 82 B15R2.14951 O=C(O)C1=NC2=CC=CC=C2C(O)=C1 4H29-1-86 [0,1,0,0,0,0|2,0,0]=3 83 B15R2.14951 O=[N+]([O-])C1=CC2=CC=CN=C2C(O)=C1 4H54-1-Z1 [0,1,0,0,0,0|3,0,0]=4 84 B15R2.61353 O=C(O)C1=NC2=C(Br)C=NC=C2C=C1 4H21-9-Y9 [0,1,0,0,0,0|3,0,0]=4 85 B13R1.74 CN(C)C1=CC=C(\C=C\C=O)C=C1 4956-1-01 [0,0,1,0,0,0|3,0,0]=4 86 B13R1.90 COC1=CC=CC=C1\C=C\C(=O)O 2921-1-01 [0,0,1,0,0,0|2,0,1]=4 87 B13R1.354 C=CCC1=C(O)C=CC(C(C)=O)=C1 2920-1-03 [0,0,1,0,0,0|1,0,1]=3 88 B13R2.72 CC(=O)N1CCC2=CC=CC=C21 4H17-1-0U [0,0,0,0,1,0|1,0,2]=4 89 B13R2.72 N=C(N)C1=CSC2=CC=CC=C21 8H56-1-X5 [0,0,0,0,1,0|3,0,0]=4 90 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 4H21-1-XT [0,0,0,0,1,0|3,0,0]=4 91 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 4H58-1-B1 [0,0,0,0,1,0|3,0,0]=4 92 B13R2.72 O=C(O)C1=CCC2=CC=CC=C21 2921-1-X2 [0,0,0,0,1,0|1,0,1]=3 93 B13R2.72 O=C(O)C1=CNC2=CC=CC=C21 4H21-1-W5 [0,0,0,0,1,0|2,0,0]=3 94 B13R2.72 O=C(O)C1=CNC2=NC=CC=C12 4H21-1-61 [0,0,0,0,1,0|3,0,0]=4 95 B13R2.72 O=C(O)C1=COC2=CC=CC=C21 2H21-1-X5 [0,0,0,0,1,0|2,0,0]=3 96 B13R2.72 O=C(O)C1=CSC2=CC=CC=C21 6H21-1-21 [0,0,0,0,1,0|2,0,0]=3 97 B13R2.72 O=C(O)C1=NNC2=CC=CC=C21 4H21-1-XL [0,0,0,0,1,0|3,0,0]=4 98 B13R2.430 CC(=O)C1=CC=C2CCCC2=C1 2717-1-X9 [0,0,0,0,1,0|0,0,3]=4 99 B13R2.430 O=C(Cl)C1=CN2C=CN=C2C=C1 4H16-5-X6 [0,0,0,0,1,0|3,0,0]=4 100 B13R2.430 O=C(O)C1=CC2=CN=CN2C=C1 4H21-1-NR [0,0,0,0,1,0|3,0,0]=4 101 B13R2.430 O=C(O)C1=CC2=NC=CN2C=C1 4H21-1-A1 [0,0,0,0,1,0|3,0,0]=4 102 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 3H21-1-X0 [0,0,0,0,1,0|2,0,0]=3 103 B13R2.430 O=C(O)C1=CC=C2C=COC2=C1 2H21-1-1G [0,0,0,0,1,0|2,0,0]=3 104 B13R2.430 O=C(O)C1=CC=C2C=NNC2=C1 4H21-1-D0 [0,0,0,0,1,0|3,0,0]=4 105 B13R2.430 O=C(O)C1=CC=C2N=COC2=C1 4H58-1-368 [0,0,0,0,1,0|3,0,0]=4 106 B13R2.430 O=C(O)C1=CC=C2N=CSC2=C1 8H70-1-V4 [0,0,0,0,1,0|3,0,0]=4 107 B13R2.430 O=C(O)C1=CC=C2NC=CC2=C1 4H21-1-21 [0,0,0,0,1,0|2,0,0]=3 108 B13R2.430 O=C(O)C1=CC=C2NN=CC2=C1 4H21-1-E8 [0,0,0,0,1,0|3,0,0]=4 109 B13R2.430 O=C(O)C1=CC=C2OC=CC2=C1 2H21-1-W9 [0,0,0,0,1,0|2,0,0]=3 110 B13R2.430 O=C(O)C1=CC=C2SC=NC2=C1 8H70-1-Z9 [0,0,0,0,1,0|3,0,0]=4 111 B13R2.430 O=C(O)C1=CN2C=CN=C2C=C1 4H21-1-D5 [0,0,0,0,1,0|3,0,0]=4 112 B13R2.430 O=C(O)C1=CN=C2NC=CC2=C1 4H21-1-BX [0,0,0,0,1,0|3,0,0]=4 113 B13R2.430 O=[N+]([O-])C1=CC=C2C=CNC2=C1 4H55-1-W7 [0,0,0,0,1,0|3,0,0]=4 114 B13R2.430 O=[N+]([O-])C1=CC=C2NC=CC2=C1 4H54-1-05 [0,0,0,0,1,0|3,0,0]=4 115 B13R2.435 CC(=O)C1=CC2=CC=CC=C2S1 6H17-1-10 [0,0,0,0,1,0|1,0,0]=2 116 B13R2.435 NC(=O)C1=CC2=CC=CC=C2N1 4H48-1-ET [0,0,0,0,1,0|2,0,0]=3 117 B13R2.435 O=C(Cl)C1=CC2=CC=CC=C2O1 2H16-5-X8 [0,0,0,0,1,0|2,0,0]=3 118 B13R2.435 O=C(Cl)C1=CC2=CC=CC=C2S1 6H16-5-X1 [0,0,0,0,1,0|2,0,0]=3 119 B13R2.435 O=C(Cl)C1=NC2=CC=CC=C2S1 8H16-5-X4 [0,0,0,0,1,0|3,0,0]=4 120 B13R2.435 O=C(O)C1=CC2=CC=CC=C2N1 4H21-1-G4 [0,0,0,0,1,0|2,0,0]=3 121 B13R2.435 O=C(O)C1=CC2=CC=CC=C2O1 2H21-1-08 [0,0,0,0,1,0|2,0,0]=3 122 B13R2.435 O=C(O)C1=CC2=CC=CC=C2S1 6H21-1-Y8 [0,0,0,0,1,0|2,0,0]=3 123 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 8H21-1-64 [0,0,0,0,1,0|3,0,0]=4 124 B13R2.435 O=C(O)C1=CC2=CN=CC=C2N1 4H21-1-DD [0,0,0,0,1,0|3,0,0]=4 125 B13R2.435 O=C(O)C1=CC2=NC=CC=C2N1 4H21-1-BG [0,0,0,0,1,0|3,0,0]=4 126 B13R2.435 O=C(O)C1=CC2=NC=CC=C2S1 8H21-1-86 [0,0,0,0,1,0|3,0,0]=4 127 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 4H21-1-16 [0,0,0,0,1,0|3,0,0]=4 128 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 4H21-1-88 [0,0,0,0,1,0|3,0,0]=4 129 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 P911-A-34 [0,0,0,0,1,0|3,0,0]=4 130 B15R2.1668 O=C(Cl)CC1=CC2=CC=CC=C2C=C1 2716-5-X8 [0,0,0,0,0,1|1,0,0]=2 131 B12R1.71 C=CCOC1=CC=C(C=O)C=C1 2615-1-0L [1,0,1,0,0,0|1,0,1]=4 132 B12R1.125 CC(=O)\C=C\C1=CC=CC=C1Cl 2917-5-22 [1,0,1,0,0,0|1,0,0]=3 133 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 2921-3-02 [1,0,1,0,0,0|2,0,0]=4 134 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 2621-1-1R [1,0,1,0,0,0|1,0,1]=4 135 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O 2921-1-Y6 [1,0,1,0,0,0|1,0,1]=4 136 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 2923-1-29 [1,0,1,0,0,0|2,0,0]=4 137 B12R1.382 C=CCOC1=CC=CC(C=O)=C1 2615-1-86 [1,0,1,0,0,0|1,0,1]=4 138 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 1600-9-X9 [2,0,0,0,0,0|1,0,0]=3 139 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 3H32-9-T0 [2,0,0,0,0,0|2,0,0]=4 140 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 3H32-9-M7 [2,0,0,0,0,0|2,0,0]=4 141 B12R2.24 BrC1=CC2=CC=CN=C2C=C1 3H32-9-Q7 [2,0,0,0,0,0|2,0,0]=4 142 B12R2.24 BrC1=CC2=CC=NC=C2C=C1 3H32-9-Q6 [2,0,0,0,0,0|2,0,0]=4 143 B12R2.24 BrC1=CC2=CN=CC=C2C=C1 3H32-9-Q5 [2,0,0,0,0,0|2,0,0]=4 144 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 3H32-9-Q4 [2,0,0,0,0,0|2,0,0]=4 145 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 3H32-9-Q3 [2,0,0,0,0,0|2,0,0]=4 146 B12R2.24 CC1=CC2=CC=NC=C2C=C1 3H32-1-K2 [2,0,0,0,0,0|1,0,0]=3 147 B12R2.24 CC1=CC2=NC=CN=C2C=C1 3H32-1-2D [2,0,0,0,0,0|2,0,0]=4 148 B12R2.24 ClC1=CC2=CC=NC=C2C=C1 3H32-5-TC [2,0,0,0,0,0|2,0,0]=4 149 B12R2.24 ClC1=CC=C2C=CC=NC2=C1 3H32-5-L1 [2,0,0,0,0,0|2,0,0]=4 150 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 3H32-5-L4 [2,0,0,0,0,0|2,0,0]=4 151 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 3H32-5-43 [2,0,0,0,0,0|2,0,0]=4 152 B12R2.24 ClC1=NC=C2C=CC=CC2=C1 3H32-5-M3 [2,0,0,0,0,0|2,0,0]=4 153 B12R2.24 FC1=CC2=CC=CC=C2C=C1 1600-3-13 [2,0,0,0,0,0|1,0,0]=3 154 B12R2.24 FC1=CC2=CC=CN=C2C=C1 3H32-3-30 [2,0,0,0,0,0|2,0,0]=4 155 B12R2.24 FC1=CC2=CC=NC=C2C=C1 3H32-3-1X [2,0,0,0,0,0|2,0,0]=4 156 B12R2.24 IC1=CC2=CC=CN=C2C=C1 3H32-H-06 [2,0,0,0,0,0|2,0,0]=4 157 B12R2.24 NC1=CC2=CC=CC=C2C=N1 3H30-1-X8 [2,0,0,0,0,0|2,0,0]=4 158 B12R2.24 NC1=CC2=CC=CN=C2C=C1 3H30-1-X1 [2,0,0,0,0,0|2,0,0]=4 159 B12R2.24 NC1=CC2=CC=NC=C2C=C1 3H30-1-06 [2,0,0,0,0,0|2,0,0]=4 160 B12R2.24 NC1=CC2=NC=CC=C2C=C1 3H30-1-GT [2,0,0,0,0,0|2,0,0]=4 161 B12R2.24 NC1=NC2=CC=CC=C2C=C1 3H30-1-D7 [2,0,0,0,0,0|2,0,0]=4 162 B12R2.24 O=C1C=C2C=CC=CC2=CN1 4H48-1-AD [2,0,0,0,0,0|1,0,0]=3 163 B12R2.24 OC1=CC2=CC=CC=C2N=C1 4H01-1-BD [2,0,0,0,0,0|1,0,1]=4 164 B12R2.24 OC1=CC2=CC=NC=C2C=C1 4H01-1-P4 [2,0,0,0,0,0|1,0,1]=4 165 B12R2.24 OC1=CC2=CN=CC=C2C=C1 4H01-1-07 [2,0,0,0,0,0|1,0,1]=4 166 B12R2.24 OC1=CC=C2N=CC=CC2=C1 4H01-1-P6 [2,0,0,0,0,0|1,0,1]=4 167 B12R2.24 OC1=NC2=CC=CC=C2C=C1 4H01-1-P2 [2,0,0,0,0,0|1,0,1]=4 168 B12R2.24 SC1=CC2=CC=CC=C2C=C1 5661-1-X1 [2,0,0,0,0,0|0,1,0]=3 169 B14R1.419 O=C(O)\C=C\C1=CC=C(C(=O)O)C=C1 2921-1-00 [0,1,1,0,0,0|2,0,0]=4 170 B14R1.4522 O=C(O)\C=C\C1=CC=CC=C1C(=O)O 2621-1-2N [0,1,1,0,0,0|2,0,0]=4 171 B14R1.4513 CC(=O)C(=CC1=CC=CC=C1)C(C)=O 2618-1-0C [0,1,1,0,0,0|0,0,1]=3 172 B14R2.92 BrCC1=C(Br)C2=CC=CC=C2C=C1 1700-9-Z9 [1,1,0,0,0,0|1,0,1]=4 173 B14R2.134 COC1=CC=C2C=CC(=O)OC2=C1 2H23-1-10 [1,1,0,0,0,0|2,0,0]=4 174 B14R2.134 O=CC1=CC2=CC(O)=CC=C2OC1 2H15-1-33 [1,1,0,0,0,0|1,0,1]=4 175 B14R2.142 COC1=CC2=C(Cl)C=CN=C2C=C1 4H07-5-Y5 [1,1,0,0,0,0|2,0,0]=4 176 B14R2.1801 COC1=CC2=NC=CC(Cl)=C2C=C1 4H07-5-Y3 [1,1,0,0,0,0|2,0,0]=4 177 B14R2.1801 COC1=CC2=NC=CC(O)=C2C=C1 4H07-1-Y0 [1,1,0,0,0,0|2,0,0]=4 178 B14R2.2332 CC1=NC2=CC=C(C=O)C=C2C=C1 4H15-1-T8 [1,1,0,0,0,0|1,0,0]=3 179 B14R2.2332 COC1=CC2=CC=C(Br)C=C2C=C1 2607-9-X4 [1,1,0,0,0,0|1,0,0]=3 180 B14R2.2332 COC1=CC2=CC=C(C)N=C2C=C1 4H07-1-Y6 [1,1,0,0,0,0|2,0,0]=4 181 B14R2.2332 N#CC1=CC=C2C=C(O)C=CC2=C1 4637-1-9R [1,1,0,0,0,0|1,0,1]=4 182 B14R2.2332 O=CC1=CC2=C(C=C1)OC(=O)C=C2 2H25-1-X5 [1,1,0,0,0,0|1,0,0]=3 183 B14R2.2332 O=CC1=CC=C2C=C(F)C=CC2=N1 4H15-3-12 [1,1,0,0,0,0|1,0,0]=3 184 B14R2.2332 O=CC1=CC=C2C=C(O)C=CC2=C1 2620-1-Y9 [1,1,0,0,0,0|0,0,0]=2 185 B14R2.95 COC(=O)C1=CCC2=CC=CC=C21 2623-1-X4 [0,1,0,0,1,0|0,0,1]=3 186 B14R2.95 COC(=O)C1=CNC2=CC=CN=C21 4H23-1-X4 [0,1,0,0,1,0|2,0,0]=4 187 B14R2.95 COC(=O)C1=CNC2=NC=CC=C12 4H23-1-M5 [0,1,0,0,1,0|2,0,0]=4 188 B14R2.95 COC(=O)C1=NNC2=CC=CC=C21 4H58-1-BA [0,1,0,0,1,0|2,0,0]=4 189 B14R2.95 O=C(CBr)C1=COC2=CC=CC=C21 2H17-9-X7 [0,1,0,0,1,0|1,0,0]=3 190 B14R2.95 O=C(CBr)C1=CSC2=CC=CC=C21 6H66-9-X4 [0,1,0,0,1,0|1,0,0]=3 191 B14R2.300 O=C(O)C1=CNC2=CC(Br)=CC=C21 4H58-9-1V [0,1,0,0,1,0|2,0,0]=4 192 B14R2.642 CC(=O)C1=C(C)N=C2C=CC=CN21 4H56-1-7E [0,1,0,0,1,0|2,0,0]=4 193 B14R2.5816 CC(=O)C1=NNC2=CC=C(Br)C=C21 4H56-9-M8 [0,1,0,0,1,0|2,0,0]=4 194 B14R2.5816 CC(=O)N1N=CC2=CC=C(Cl)C=C21 4H48-5-X2 [0,1,0,0,1,0|2,0,0]=4 195 B14R2.5816 NC(=O)C1=CNC2=CC=C(N)C=C21 4H48-5-Z4 [0,1,0,0,1,0|2,0,0]=4 196 B14R2.8032 CC(=O)N1N=CC2=C(Cl)C=CC=C21 4H48-5-Y7 [0,1,0,0,1,0|2,0,0]=4 197 B14R2.25733 CN1C=C(C(=O)O)C2=CC=CC=C21 4H58-1-153 [0,1,0,0,1,0|2,0,0]=4 198 B14R2.624 O=C(O)C1=C(F)C=C2C=COC2=C1 2H21-3-0K [0,1,0,0,1,0|2,0,0]=4 199 B14R2.966 COC(=O)C1=CC2=NC=CN2C=C1 4H23-1-Y0 [0,1,0,0,1,0|2,0,0]=4 200 B14R2.966 COC(=O)C1=CC=C2C=CNC2=C1 4H23-1-16 [0,1,0,0,1,0|1,0,0]=3 201 B14R2.966 COC(=O)C1=CC=C2C=NNC2=C1 4H23-1-08 [0,1,0,0,1,0|2,0,0]=4 202 B14R2.966 COC(=O)C1=CC=C2NC=CC2=C1 4H23-1-15 [0,1,0,0,1,0|1,0,0]=3 203 B14R2.966 COC(=O)C1=CC=C2NC=NC2=C1 4H23-1-Q7 [0,1,0,0,1,0|2,0,0]=4 204 B14R2.966 COC(=O)C1=CC=C2NN=CC2=C1 4H23-1-24 [0,1,0,0,1,0|2,0,0]=4 205 B14R2.966 COC(=O)C1=CC=C2OC=NC2=C1 4H56-1-3F [0,1,0,0,1,0|2,0,0]=4 206 B14R2.966 COC(=O)C1=CN2C=CN=C2C=C1 4H23-1-03 [0,1,0,0,1,0|2,0,0]=4 207 B14R2.966 COC(=O)C1=CN2C=CN=C2C=C1 4H23-5-X6 [0,1,0,0,1,0|2,0,0]=4 208 B14R2.966 O=C(CBr)C1=CC=C2SC=CC2=C1 6H66-9-X1 [0,1,0,0,1,0|1,0,0]=3 209 B14R2.5719 CN1C=CC2=CC(C(=O)O)=CC=C21 4H56-1-6D [0,1,0,0,1,0|2,0,0]=4 210 B14R2.8824 O=C(O)C1=CC(Br)=C2C=CNC2=C1 4H21-9-0H [0,1,0,0,1,0|2,0,0]=4 211 B14R2.24358 CC(=O)C1=CC=C2C=NN(C)C2=C1 4H56-1-F4 [0,1,0,0,1,0|2,0,0]=4 212 B14R2.450 CC(=O)C1=C(C)C2=CC=CC=C2S1 6H17-1-X1 [0,1,0,0,1,0|1,0,0]=3 213 B14R2.450 CC1=C(C(=O)O)OC2=CC=CC=C21 2H21-1-06 [0,1,0,0,1,0|2,0,0]=4 214 B14R2.450 NC(=O)C1=C(Cl)C2=CC=CC=C2S1 8H48-5-16 [0,1,0,0,1,0|2,0,0]=4 215 B14R2.450 NC1=C(C(=O)O)SC2=CC=CC=C21 8H57-1-X2 [0,1,0,0,1,0|2,0,0]=4 216 B14R2.450 O=C(O)C1=C(Br)C2=CC=CC=C2N1 4H58-9-93 [0,1,0,0,1,0|2,0,0]=4 217 B14R2.972 COC(=O)C1=CC2=CC=CC=C2O1 2H23-1-13 [0,1,0,0,1,0|1,0,0]=3 218 B14R2.972 COC(=O)C1=CC2=NC=CC=C2S1 8H66-1-2R [0,1,0,0,1,0|2,0,0]=4 219 B14R2.972 NNC(=O)C1=CC2=CC=CC=C2N1 4H56-1-L5 [0,1,0,0,1,0|2,0,0]=4 220 B14R2.972 NNC(=O)C1=CC2=CC=CC=C2O1 4H56-1-7N [0,1,0,0,1,0|2,0,0]=4 221 B14R2.972 O=C(CBr)C1=CC2=CC=CC=C2O1 2H17-9-X2 [0,1,0,0,1,0|1,0,0]=3 222 B14R2.972 O=C(CBr)C1=NC2=CC=CC=C2S1 8H17-9-01 [0,1,0,0,1,0|2,0,0]=4 223 B14R2.4529 CC(=O)C1=CC2=CC(Br)=CC=C2O1 2H17-9-31 [0,1,0,0,1,0|1,0,0]=3 224 B14R2.4529 CC(=O)C1=CC2=CC(Cl)=CC=C2O1 2H17-5-21 [0,1,0,0,1,0|1,0,0]=3 225 B14R2.4529 CC(=O)N1C=C2C=C(Br)C=CC2=N1 4H48-9-V8 [0,1,0,0,1,0|2,0,0]=4 226 B14R2.4529 CC1=CC=C2C=C(C(=O)O)SC2=C1 6H21-1-X7 [0,1,0,0,1,0|2,0,0]=4 227 B14R2.4529 CC1=CC=C2SC(C(=O)O)=CC2=C1 6H21-1-0W [0,1,0,0,1,0|2,0,0]=4 228 B14R2.4529 NC1=CC=C2SC(C(=O)O)=CC2=C1 8H57-1-X3 [0,1,0,0,1,0|2,0,0]=4 229 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2N1 4H21-9-Y6 [0,1,0,0,1,0|2,0,0]=4 230 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2O1 2H21-9-X2 [0,1,0,0,1,0|2,0,0]=4 231 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 6H21-9-X3 [0,1,0,0,1,0|2,0,0]=4 232 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2O1 2H21-5-X0 [0,1,0,0,1,0|2,0,0]=4 233 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2N1 4H21-3-Y0 [0,1,0,0,1,0|2,0,0]=4 234 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2O1 2H21-3-0C [0,1,0,0,1,0|2,0,0]=4 235 B14R2.4529 O=C(O)C1=CC2=CC(F)=CC=C2S1 6H21-3-52 [0,1,0,0,1,0|2,0,0]=4 236 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2N1 4H21-9-Y7 [0,1,0,0,1,0|2,0,0]=4 237 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2S1 6H21-9-X6 [0,1,0,0,1,0|2,0,0]=4 238 B14R2.4529 O=C(O)C1=CC2=CC=C(Cl)C=C2S1 6H21-5-X1 [0,1,0,0,1,0|2,0,0]=4 239 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2N1 4H21-3-62 [0,1,0,0,1,0|2,0,0]=4 240 B14R2.4529 O=C(O)C1=CC2=CC=C(F)C=C2S1 6H21-3-X4 [0,1,0,0,1,0|2,0,0]=4 241 B14R2.7969 CC1=C2C=C(C(=O)O)NC2=CC=C1 4H58-1-004 [0,1,0,0,1,0|2,0,0]=4 242 B14R2.7969 O=C(Cl)C1=CC2=CC=CC(Br)=C2S1 6H66-D-05 [0,1,0,0,1,0|2,0,0]=4 243 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2S1 6H21-9-00 [0,1,0,0,1,0|2,0,0]=4 244 B14R2.7969 O=C(O)C1=CC2=C(Cl)C=CC=C2S1 6H21-5-X5 [0,1,0,0,1,0|2,0,0]=4 245 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2N1 4H21-3-20 [0,1,0,0,1,0|2,0,0]=4 246 B14R2.7969 O=C(O)C1=CC2=C(F)C=CC=C2S1 6H21-3-02 [0,1,0,0,1,0|2,0,0]=4 247 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2O1 2H21-9-0D [0,1,0,0,1,0|2,0,0]=4 248 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2S1 6H21-9-10 [0,1,0,0,1,0|2,0,0]=4 249 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2O1 2H21-5-08 [0,1,0,0,1,0|2,0,0]=4 250 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2S1 6H21-5-X0 [0,1,0,0,1,0|2,0,0]=4 251 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2S1 6H21-3-72 [0,1,0,0,1,0|2,0,0]=4 252 B16R2.12044 CC1=CC2=C(O)C(C(=O)O)=CN=C2C=C1 4H21-1-NV [0,2,0,0,0,0|2,0,0]=4 253 B16R2.12044 O=C(O)C1=C(O)C2=CC(F)=CC=C2N=C1 4H29-3-05 [0,2,0,0,0,0|2,0,0]=4 254 B16R2.12044 O=C(O)C1=CNC2=C(C=C(F)C=C2)C1=O 4H29-3-X1 [0,2,0,0,0,0|2,0,0]=4 255 B16R2.12044 O=C(O)C1=COC2=CC=C(F)C=C2C1=O 2H29-3-01 [0,2,0,0,0,0|2,0,0]=4 256 B16R2.22861 O=C(O)C1=C(O)C2=CC=CC(F)=C2N=C1 4H21-3-X0 [0,2,0,0,0,0|2,0,0]=4 257 B16R2.23331 O=C(O)C1=C(O)C2=CC=CC=C2C(O)=C1 2629-1-T7 [0,2,0,0,0,0|1,0,0]=3 258 B16R2.133456 O=C(O)C1=C(O)C2=CC=C(Br)C=C2N=C1 4H21-9-1E [0,2,0,0,0,0|2,0,0]=4 259 B16R2.23521 CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O 2H29-9-X1 [0,2,0,0,0,0|1,0,0]=3 260 B16R2.23521 CC1=CC2=CC(C(=O)O)=C(C)N=C2C=C1 4H21-1-5C [0,2,0,0,0,0|2,0,0]=4 261 B16R2.23521 O=C(O)C1=CC2=CC(Cl)=CC=C2OC1=O 2H25-5-0E [0,2,0,0,0,0|2,0,0]=4 262 B16R2.767 CCOC(=O)C1=CC2=CC=CC=C2C=C1 2623-1-05 [0,2,0,0,0,0|0,0,0]=2 263 B16R2.767 CCOC(=O)C1=CC2=CC=CC=C2C=N1 4H23-1-U5 [0,2,0,0,0,0|1,0,0]=3 264 B16R2.767 CCOC(=O)C1=CC2=NC=CN=C2C=C1 4H23-1-X2 [0,2,0,0,0,0|2,0,0]=4 265 B16R2.33799 COC(=O)C1=CC2=CC=C(C)N=C2C=C1 4H23-1-LX [0,2,0,0,0,0|1,0,0]=3 266 B16R2.33799 COC(=O)C1=CC2=CC=C(O)C=C2C=C1 2623-1-5A [0,2,0,0,0,0|0,0,0]=2 267 B16R2.133406 O=C(O)C1=CC(=O)C2=CC=C(F)C=C2O1 2H29-3-0A [0,2,0,0,0,0|2,0,0]=4 268 B16R2.7486 COC1=CC2=CC=C(C(=O)O)C=C2C=C1 2621-1-Z4 [0,2,0,0,0,0|1,0,0]=3 269 B16R2.7486 COC1=CC2=CC=C(C(C)=O)C=C2C=C1 2617-1-Y6 [0,2,0,0,0,0|0,0,0]=2 270 B16R2.23501 O=C(O)C1=CC(=O)C2=CC(F)=CC=C2O1 2H29-3-X0 [0,2,0,0,0,0|2,0,0]=4 271 B14R2.256 CC1=CC=C(C2=CC=CC=C2N)O1 4H30-5-X8 [0,0,1,1,0,0|1,0,1]=4 272 B14R2.31359 CC(=O)C1=CC=CC2=CC=CC=C21 2617-1-X8 [0,0,1,1,0,0|0,0,0]=2 273 B14R2.31359 CC(=O)C1=CC=CC2=CC=CN=C21 4H17-1-0R [0,0,1,1,0,0|1,0,0]=3 274 B14R2.31359 C[C@@H](N)C1=CC=CC2=CC=CC=C21 3730-1-R2 [0,0,1,1,0,0|1,0,1]=4 275 B14R2.31359 C[C@H](N)C1=CC=CC2=CC=CC=C21 3630-1-Y3 [0,0,1,1,0,0|1,0,1]=4 276 B14R2.31359 NC(=O)C1=CC=CC2=CC=CC=C21 4648-1-16 [0,0,1,1,0,0|1,0,0]=3 277 B14R2.31359 O=C(O)C1=C2C=CC=CC2=CC=N1 4H21-1-XM [0,0,1,1,0,0|2,0,0]=4 278 B14R2.31359 O=C(O)C1=C2N=CC=CC2=CC=C1 4H21-1-C9 [0,0,1,1,0,0|2,0,0]=4 279 B14R2.31359 O=C(O)C1=CC=CC2=CC=NC=C21 4H21-1-B0 [0,0,1,1,0,0|2,0,0]=4 280 B14R2.31359 O=C(O)C1=CC=CC2=CN=CC=C21 4H21-1-B2 [0,0,1,1,0,0|2,0,0]=4 281 B14R2.31359 O=C(O)C1=CC=CC2=NC=CC=C12 4H58-1-171 [0,0,1,1,0,0|2,0,0]=4 282 B14R2.31359 O=C(O)C1=CC=NC2=CC=CC=C21 4H21-1-2P [0,0,1,1,0,0|2,0,0]=4 283 B14R2.31359 O=[N+]([O-])C1=C2C=CC=CC2=CC=C1 4654-1-54 [0,0,1,1,0,0|2,0,0]=4 284 B12R2.1 O=CC1=CNC2=CC=CC=C12 4H15-1-N4 [1,0,0,0,1,0|1,0,0]=3 285 B12R2.1 O=CC1=CNC2=NC=CC=C12 4H15-1-1G [1,0,0,0,1,0|2,0,0]=4 286 B12R2.1 O=CC1=CSC2=CC=CC=C12 6H15-1-Y2 [1,0,0,0,1,0|1,0,0]=3 287 B12R2.32 CCC1=CC2=CC=CC=C2O1 2H10-1-0V [1,0,0,0,1,0|1,0,1]=4 288 B12R2.32 O=CC1=CC2=CC=CC=C2N1 4H15-1-X6 [1,0,0,0,1,0|1,0,0]=3 289 B12R2.32 O=CC1=CC2=CC=CC=C2O1 2H15-1-07 [1,0,0,0,1,0|1,0,0]=3 290 B12R2.32 O=CC1=CC2=CC=CC=C2S1 6H15-1-X6 [1,0,0,0,1,0|1,0,0]=3 291 B12R2.32 O=CC1=CC2=CC=CN=C2S1 8H70-1-W2 [1,0,0,0,1,0|2,0,0]=4 292 B12R2.32 O=CC1=NC2=CC=CC=C2N1 4H15-1-X1 [1,0,0,0,1,0|2,0,0]=4 293 B12R2.44 COC1=CC=C2C=CNC2=C1 4H56-1-ZL [1,0,0,0,1,0|2,0,0]=4 294 B12R2.44 COC1=CC=C2NC=CC2=C1 4H56-1-ZK [1,0,0,0,1,0|2,0,0]=4 295 B12R2.44 COC1=CC=C2OC=CC2=C1 2608-1-Y0 [1,0,0,0,1,0|2,0,0]=4 296 B12R2.44 O=CC1=CC=C2C=CNC2=C1 4H15-1-16 [1,0,0,0,1,0|1,0,0]=3 297 B12R2.44 O=CC1=CC=C2C=NNC2=C1 4H15-1-1L [1,0,0,0,1,0|2,0,0]=4 298 B12R2.44 O=CC1=CC=C2NC=CC2=C1 4H15-1-10 [1,0,0,0,1,0|1,0,0]=3 299 B12R2.44 O=CC1=CC=C2NC=NC2=C1 4H15-1-L6 [1,0,0,0,1,0|2,0,0]=4 300 B12R2.44 O=CC1=CC=C2NN=CC2=C1 4H15-1-0D [1,0,0,0,1,0|2,0,0]=4 301 B12R2.44 O=CC1=CC=C2OC=CC2=C1 2H15-1-X4 [1,0,0,0,1,0|1,0,0]=3 302 B16R2.477 O=C(O)COC1=CC2=CC=CC=C2C=C1 2621-1-75 [0,0,0,0,0,2|1,0,0]=3 303 B16R2.477 O=C(O)\C=C\C1=CC2=CC=CC=C2C=C1 2921-1-Y7 [0,0,0,0,0,2|1,0,0]=3