0 B9R1.8 CNCC1=CN=CN=C1 3H31-1-5J [0,0,0,0,0,0|3,0,0]=3 1 B9R1.8 N#CCC1=CC=CN=N1 3H37-1-0D [0,0,0,0,0,0|3,0,1]=4 2 B9R1.8 NNCC1=CN=CC=N1 3H39-1-34 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.8 NNCC1=CN=CN=C1 3H39-5-20 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.8 NOCC1=CC=CN=C1 4H47-1-62 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.8 O=C=NC1=CC=CN=C1 4H49-1-02 [0,0,0,0,0,0|3,0,1]=4 6 B8R1.2 CNC1=CC=NC=N1 3H32-1-LX [1,0,0,0,0,0|3,0,0]=4 7 B8R1.2 ClCC1=CC=CN=N1 3H32-5-D3 [1,0,0,0,0,0|3,0,0]=4 8 B8R1.2 ICC1=CC=CN=C1 3H32-H-90 [1,0,0,0,0,0|2,0,0]=3 9 B8R1.2 NCC1=CC=CN=N1 3H30-1-U2 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.2 NCC1=CC=NC=N1 3H30-5-45 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.2 NCC1=CC=NN=C1 3H32-5-C3 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.2 SCC1=CC=CN=C1 7H61-1-08 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.1 CCCC1=CC=C(F)C=C1 1700-3-14 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.1 CCOC1=CC=C(N)N=C1 4H30-1-AC [0,1,0,0,0,0|2,0,0]=3 15 B10R1.1 CCOC1=CC=C(O)C=N1 4H07-1-4T [0,1,0,0,0,0|2,0,0]=3 16 B10R1.1 CCOC1=NC=C(Cl)C=C1 4H07-5-2R [0,1,0,0,0,0|2,0,0]=3 17 B10R1.1 CCSC1=CC=C(O)C=C1 6666-1-0Z [0,1,0,0,0,0|3,0,0]=4 18 B10R1.1 CCSC1=NC=C(Cl)C=C1 7H66-5-0W [0,1,0,0,0,0|2,0,0]=3 19 B10R1.1 COCC1=CC=C(Cl)C=C1 2607-5-29 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.1 N#CCC1=CC=C(Cl)C=N1 3H37-5-30 [0,1,0,0,0,0|2,0,1]=4 21 B10R1.4 CCSC1=C(O)C=CC=C1 6666-1-1Q [0,1,0,0,0,0|3,0,0]=4 22 B10R1.4 CNCC1=C(O)C=CC=C1 4633-5-06 [0,1,0,0,0,0|3,0,0]=4 23 B10R1.4 N#CCC1=NC=CC=C1Br 3H37-9-0T [0,1,0,0,0,0|2,0,1]=4 24 B10R1.10 CC1=CC=CC(CCN)=N1 3H30-1-4S [0,1,0,0,0,0|2,0,0]=3 25 B10R1.10 CCNC1=NC=CC(Cl)=N1 3H31-5-5K [0,1,0,0,0,0|3,0,0]=4 26 B10R1.10 CCOC1=CC=NC(Cl)=N1 4H56-5-AE [0,1,0,0,0,0|3,0,0]=4 27 B10R1.10 CCSC1=CC=CC(O)=C1 6666-1-1K [0,1,0,0,0,0|3,0,0]=4 28 B10R1.10 CNCC1=CC(C)=CC=N1 3H31-1-AZ [0,1,0,0,0,0|2,0,0]=3 29 B10R1.10 CNCC1=CC(Cl)=CC=N1 3H31-5-0D [0,1,0,0,0,0|2,0,0]=3 30 B10R1.10 COCC1=CC(O)=CC=C1 2607-1-2K [0,1,0,0,0,0|3,0,0]=4 31 B10R1.10 N#CCC1=CC(F)=CN=C1 3H37-3-47 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 2602-1-R4 [0,1,0,0,0,0|2,0,0]=3 33 B10R1.15 C\C(=N\O)C1=NC=CN=C1 4H50-1-Z0 [0,1,0,0,0,0|2,0,1]=4 34 B10R1.15 NCC(O)C1=CC=CC=N1 4H30-1-6H [0,1,0,0,0,0|2,0,0]=3 35 B10R1.17 CCCCC1=CC=NC=C1 3H32-1-JJ [0,1,0,0,0,0|3,0,0]=4 36 B10R1.17 CCOCC1=CC=CC=C1 2607-1-1V [0,1,0,0,0,0|2,0,0]=3 37 B10R1.18 CC(C)CC1=CC=NC=C1 3H32-5-JC [0,1,0,0,0,0|3,0,0]=4 38 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 2702-1-X0 [0,1,0,0,0,0|2,0,0]=3 39 B10R2.7 C1=CN=C2NC=NC2=N1 3H31-1-9S [0,0,0,1,0,0|2,0,1]=4 40 B10R2.7 C1=CN=C2NN=CC2=N1 3H31-1-4Y [0,0,0,1,0,0|2,0,1]=4 41 B10R2.7 C1=NC=C2CCNC2=C1 3H31-1-19 [0,0,0,1,0,0|2,0,0]=3 42 B10R2.320 OC1CC2=CC=CC=C21 2602-1-0H [0,0,0,1,0,0|3,0,0]=4 43 B8R1.8 BrCCN1C=CC=N1 3H32-9-CK [0,0,0,0,1,0|2,0,0]=3 44 B8R1.8 NCCC1=CC=CS1 7H30-5-0B [0,0,0,0,1,0|2,0,0]=3 45 B8R1.8 NCCC1=CN=CN1 3H30-5-1X [0,0,0,0,1,0|1,0,1]=3 46 B8R1.8 NCCC1=NN=CS1 7H70-5-85 [0,0,0,0,1,0|3,0,0]=4 47 B8R1.8 NCCC1=NNC=C1 3H30-5-6U [0,0,0,0,1,0|2,0,0]=3 48 B8R1.8 OCCN1C=NN=C1 4H56-1-0G4 [0,0,0,0,1,0|3,0,0]=4 49 B9R1.1 CC1=CC=C(CCl)N=C1 3H32-5-CY [1,1,0,0,0,0|2,0,0]=4 50 B9R1.1 CCC1=CC=C(Br)N=C1 3H32-9-5W [1,1,0,0,0,0|1,0,0]=3 51 B9R1.1 CCC1=NNC(=O)C=C1 4H48-1-08A [1,1,0,0,0,0|2,0,0]=4 52 B9R1.1 CNC1=CC=C(Br)N=C1 3H31-9-0Z [1,1,0,0,0,0|2,0,0]=4 53 B9R1.1 CNC1=CC=C(F)C=N1 3H32-3-6Y [1,1,0,0,0,0|2,0,0]=4 54 B9R1.1 CNC1=CC=C(F)C=N1 3H32-7-5E [1,1,0,0,0,0|2,0,0]=4 55 B9R1.1 COC1=CN=C(O)C=C1 4H07-1-6A [1,1,0,0,0,0|2,0,0]=4 56 B9R1.1 CSC1=CC=C(O)C=N1 8H66-1-AP [1,1,0,0,0,0|2,0,0]=4 57 B9R1.1 FC1=CC=C(CBr)N=C1 3H32-B-2G [1,1,0,0,0,0|2,0,0]=4 58 B9R1.1 NCC1=CC=C(F)C=N1 3H30-7-71 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.1 NCC1=CC=C(N)C=N1 3H30-1-JC [1,1,0,0,0,0|2,0,0]=4 60 B9R1.1 NCC1=CC=C(N)N=C1 3H30-1-Y2 [1,1,0,0,0,0|2,0,0]=4 61 B9R1.2 CC1=CN=CC(CN)=C1 3H30-1-9X [1,1,0,0,0,0|2,0,0]=4 62 B9R1.2 CNC1=CC(Br)=CC=N1 3H31-9-18 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.2 CNC1=CC(Cl)=CC=N1 3H31-5-5V [1,1,0,0,0,0|2,0,0]=4 64 B9R1.2 CNC1=CN=CC(Br)=C1 2H31-9-00 [1,1,0,0,0,0|2,0,0]=4 65 B9R1.2 COC1=CC=CC(O)=N1 4H07-1-4R [1,1,0,0,0,0|2,0,0]=4 66 B9R1.2 COC1=CN=CC(F)=C1 4H06-3-00 [1,1,0,0,0,0|2,0,0]=4 67 B9R1.2 CSC1=CN=CC(O)=C1 8H66-1-AQ [1,1,0,0,0,0|2,0,0]=4 68 B9R1.2 CSC1=NC(Cl)=CC=C1 8H66-5-4P [1,1,0,0,0,0|2,0,0]=4 69 B9R1.2 ClCC1=CC=CC(Cl)=N1 3H32-5-JS [1,1,0,0,0,0|2,0,0]=4 70 B9R1.2 FC1=CN=CC(CBr)=C1 3H32-B-75 [1,1,0,0,0,0|2,0,0]=4 71 B9R1.2 NCC1=CC=CC(Br)=N1 3H30-D-21 [1,1,0,0,0,0|2,0,0]=4 72 B9R1.2 NCC1=CC=CC(N)=N1 3H30-1-JL [1,1,0,0,0,0|2,0,0]=4 73 B9R1.2 OCC1=CN=CC(O)=C1 4H56-1-0LK [1,1,0,0,0,0|2,0,0]=4 74 B9R1.6 CC(N)C1=CC=NN=C1 3H30-1-DF [1,1,0,0,0,0|2,0,0]=4 75 B9R1.6 CN(N)C1=NC=CN=C1 3H39-1-0B [1,1,0,0,0,0|1,0,0]=3 76 B9R1.15 CC1=CC=NC=C1CO 4H01-1-AZ [1,1,0,0,0,0|2,0,0]=4 77 B9R1.15 CC1=NC=CC=C1CCl 3H32-5-E3 [1,1,0,0,0,0|2,0,0]=4 78 B9R1.15 CC1=NC=CC=C1CN 3H30-1-JR [1,1,0,0,0,0|2,0,0]=4 79 B9R1.15 CCC1=CN=CN=C1O 4H56-1-0HW [1,1,0,0,0,0|2,0,0]=4 80 B9R1.15 CNC1=C(Cl)N=CC=C1 3H31-5-AG [1,1,0,0,0,0|2,0,0]=4 81 B9R1.15 NC1=NC=CN=C1CO 4H56-1-456 [1,1,0,0,0,0|1,0,0]=3 82 B9R1.15 NCC1=NC=CC=C1N 3H30-1-JJ [1,1,0,0,0,0|2,0,0]=4 83 B9R1.7 CCCC1=CC=C(Br)S1 5H66-9-26 [0,1,0,0,1,0|1,0,0]=3 84 B9R1.7 CCCN1C=C(N)N=N1 3H32-1-CD [0,1,0,0,1,0|2,0,0]=4 85 B9R1.7 CCOC1=NNC(Br)=C1 4H56-9-3K [0,1,0,0,1,0|2,0,0]=4 86 B9R1.7 CNCC1=CN(C)N=C1 3H33-5-1H [0,1,0,0,1,0|2,0,0]=4 87 B9R1.7 CNCC1=NN(C)C=C1 3H31-1-83 [0,1,0,0,1,0|2,0,0]=4 88 B9R1.7 COCC1=CC(N)=NN1 4H56-1-802 [0,1,0,0,1,0|2,0,0]=4 89 B9R1.11 CNC(C)C1=COC=C1 4H31-1-1Y [0,1,0,0,1,0|2,0,0]=4 90 B9R1.11 NCC(O)C1=CC=CO1 4H30-1-T0 [0,1,0,0,1,0|2,0,0]=4 91 B9R1.12 ClCCCN1C=CC=N1 3H32-5-VH [0,1,0,0,1,0|1,0,0]=3 92 B9R1.12 ClCCCN1C=CN=C1 3H32-5-JD [0,1,0,0,1,0|1,0,0]=3 93 B9R1.12 NCCCN1C=NN=C1 3H30-1-HU [0,1,0,0,1,0|2,0,0]=4 94 B9R1.13 C[C@H](O)CN1C=NC=N1 4H02-1-S0 [0,1,0,0,1,0|1,0,0]=3 95 B9R1.33 CC1=C(CCCl)SC=N1 7H70-5-1T [0,1,0,0,1,0|2,0,0]=4 96 B9R1.33 CCCN1N=CC=C1Br 3H32-9-DJ [0,1,0,0,1,0|1,0,0]=3 97 B9R1.33 CCCN1N=CC=C1Cl 3H32-5-TK [0,1,0,0,1,0|1,0,0]=3 98 B9R1.33 CCCN1N=CC=C1O 4H01-1-DK [0,1,0,0,1,0|1,0,0]=3 99 B11R1.1 CCCNC1=NC=C(Cl)C=N1 3H31-5-B7 [0,2,0,0,0,0|2,0,0]=4 100 B11R1.1 CCCOC1=CC=C(Cl)C=C1 2607-5-25 [0,2,0,0,0,0|2,0,0]=4 101 B11R1.1 CCCOC1=NC=C(Cl)C=C1 4H07-5-2N [0,2,0,0,0,0|1,0,0]=3 102 B11R1.1 CCCSC1=CC=C(O)C=C1 6666-1-0W [0,2,0,0,0,0|2,0,0]=4 103 B11R1.20 CC(C)CC1=CC=C(O)C=C1 2701-1-1K [0,2,0,0,0,0|2,0,0]=4 104 B11R1.20 CC(C)NC1=CC=C(F)C=N1 3H31-3-1M [0,2,0,0,0,0|2,0,0]=4 105 B11R1.20 CC(C)OC1=CC=C(O)C=N1 4H07-1-4S [0,2,0,0,0,0|2,0,0]=4 106 B11R1.20 CC(C)SC1=NC=C(Cl)C=C1 7H66-5-0V [0,2,0,0,0,0|2,0,0]=4 107 B11R1.81 CCOC1=NC=C(Cl)C=C1C 4H07-5-2S [0,2,0,0,0,0|2,0,0]=4 108 B11R1.81 CCOC1=NC=C(Cl)C=C1Cl 4H07-5-3D [0,2,0,0,0,0|2,0,0]=4 109 B11R1.81 CCOC1=NC=C(Cl)C=C1N 4H30-5-1E [0,2,0,0,0,0|2,0,0]=4 110 B11R1.17 CCCCC1=NC=CN=C1C 3H32-1-JF [0,2,0,0,0,0|0,0,0]=2 111 B11R1.17 CCCOC1=CC=CC=C1N 4656-1-5B [0,2,0,0,0,0|2,0,0]=4 112 B11R1.17 CCCOC1=NC=CC=C1N 4H30-1-BX [0,2,0,0,0,0|1,0,0]=3 113 B11R1.17 CCCOC1=NC=CC=C1O 4H07-1-5N [0,2,0,0,0,0|1,0,0]=3 114 B11R1.17 CCNCC1=C(O)C=CC=C1 4631-1-19 [0,2,0,0,0,0|2,0,0]=4 115 B11R1.17 OCCOC1=C(Cl)N=CC=C1 4H07-5-3G [0,2,0,0,0,0|2,0,0]=4 116 B11R1.41 CCOC1=CC=CN=C1CN 4H30-1-CA [0,2,0,0,0,0|2,0,0]=4 117 B11R1.41 CCOC1=NC=CC=C1C=O 4H56-1-875 [0,2,0,0,0,0|2,0,0]=4 118 B11R1.23 COC(=O)C1=CN=CC(C)=N1 4H58-1-ZY [0,2,0,0,0,0|1,0,1]=4 119 B11R1.24 CCCOC1=CC(Cl)=CC=C1 2607-5-2C [0,2,0,0,0,0|2,0,0]=4 120 B11R1.24 CCCOC1=CC(O)=CC=C1 2607-1-2C [0,2,0,0,0,0|2,0,0]=4 121 B11R1.24 CCCSC1=CC(O)=CC=C1 6666-1-1G [0,2,0,0,0,0|2,0,0]=4 122 B11R1.24 CCNCC1=CC=CC(F)=C1 3H31-3-0R [0,2,0,0,0,0|2,0,0]=4 123 B11R1.157 CC(C)OC1=CC=CC(Cl)=N1 4H56-5-FV [0,2,0,0,0,0|2,0,0]=4 124 B11R1.189 N#CC1=CC(CCO)=CN=C1 4H37-1-3V [0,2,0,0,0,0|2,0,0]=4 125 B11R1.7 CC(C)(CN)C1=CN=CC=N1 3H30-1-9P [0,2,0,0,0,0|1,0,0]=3 126 B11R1.16 CC(CCN)C1=CC=CC=C1 3630-1-26 [0,2,0,0,0,0|2,0,0]=4 127 B11R1.28 OCCC#CC1=CC=CC=N1 4H56-1-0G7 [0,2,0,0,0,0|1,0,1]=4 128 B11R1.28 OCCC#CC1=CC=CN=C1 4H37-1-3C [0,2,0,0,0,0|1,0,1]=4 129 B11R1.28 OCCCCC1=CC=CC=N1 4H01-1-B5 [0,2,0,0,0,0|1,0,0]=3 130 B11R1.91 CC(C)COC1=CC=CC=N1 4H07-1-5Z [0,2,0,0,0,0|1,0,0]=3 131 B11R1.91 CC(C)NCC1=CC=CN=C1 3H31-1-A0 [0,2,0,0,0,0|1,0,0]=3 132 B11R1.91 NC(=O)CCC1=CC=CC=N1 4H48-1-VK [0,2,0,0,0,0|1,0,1]=4 133 B11R1.91 NC(=O)CCC1=CC=CN=C1 4H48-1-VL [0,2,0,0,0,0|1,0,1]=4 134 B11R1.91 O=C(Cl)CCC1=CC=CN=C1 4H16-5-67 [0,2,0,0,0,0|1,0,1]=4 135 B9R2.2 C1=CN(C2CC2)C=N1 3H32-1-A6 [0,0,0,1,1,0|1,0,0]=3 136 B11R2.34 ClC1=NC=C(C2CC2)C=C1 3H32-5-US [0,1,0,1,0,0|1,0,0]=3 137 B11R2.36 BrC1=CN=C2CNCC2=C1 3H32-D-91 [0,1,0,1,0,0|2,0,0]=4 138 B11R2.36 ClC1=CC=C2CNCC2=N1 3H31-5-2T [0,1,0,1,0,0|2,0,0]=4 139 B11R2.36 ClC1=CC=C2COCC2=N1 4H56-5-NF [0,1,0,1,0,0|2,0,0]=4 140 B11R2.36 OC1=NN=C2CCCC2=C1 4H01-1-CG [0,1,0,1,0,0|2,0,0]=4 141 B11R2.10 CC1CC2=CC=CN=C2N1 3H31-1-GX [0,1,0,1,0,0|1,0,0]=3 142 B11R2.10 C[C@H]1CC2=CC=CC=C2N1 3H31-1-S1 [0,1,0,1,0,0|2,0,0]=4 143 B11R2.106 BrC1=CN=CC2=C1NCC2 3H32-9-7A [0,1,0,1,0,0|2,0,0]=4 144 B11R2.106 ClC1=NC=NC2=C1CCC2 3H32-5-FU [0,1,0,1,0,0|2,0,0]=4 145 B11R2.106 O=C1N=CNC2=C1CCC2 4H48-1-00L [0,1,0,1,0,0|2,0,0]=4 146 B11R2.106 OC1=CC=NC2=C1CCN2 4H01-1-FX [0,1,0,1,0,0|2,0,0]=4 147 B11R2.988 NCC1CC2=CC=CC=C21 3630-1-0F [0,1,0,1,0,0|2,0,0]=4 148 B11R2.35 NC1=CC(C2CC2)=NC=N1 3H30-1-0M [0,1,0,1,0,0|2,0,0]=4 149 B11R2.1 CC1=NNC2=NC=CN=C12 3H31-1-5D [0,1,0,1,0,0|1,0,1]=4 150 B11R2.1 NC1CCC2=CC=CN=C21 3H30-1-VW [0,1,0,1,0,0|1,0,0]=3 151 B11R2.1 NC1COC2=NC=CC=C21 4H30-1-CV [0,1,0,1,0,0|2,0,0]=4 152 B11R2.1 O=C1CCC2=NC=CC=C12 4H17-1-3K [0,1,0,1,0,0|1,0,1]=4 153 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 3630-5-34 [0,1,0,1,0,0|2,0,0]=4 154 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 3632-5-07 [0,1,0,1,0,0|2,0,0]=4 155 B11R2.40 CC1(C2=CC=NN=C2)CC1 3H30-5-7G [0,1,0,1,0,0|2,0,0]=4 156 B11R2.40 NC1(C2=CC=CC=N2)CC1 3H30-1-0B [0,1,0,1,0,0|1,0,0]=3 157 B11R2.40 NC1(C2=CC=CN=C2)CC1 3H30-5-6V [0,1,0,1,0,0|1,0,0]=3 158 B11R2.40 NC1(C2=CN=CN=C2)CC1 3H30-5-7F [0,1,0,1,0,0|2,0,0]=4 159 B11R2.239 C1=CC=C(C2CNC2)N=C1 3H31-5-3Q [0,1,0,1,0,0|1,0,0]=3 160 B7R1.1 CCC1=CSC=N1 7H70-1-2D [1,0,0,0,1,0|1,0,0]=3 161 B7R1.1 CCC1=NN=CO1 4H56-1-03D [1,0,0,0,1,0|2,0,0]=4 162 B7R1.1 ClCC1=NC=CS1 7H70-5-0G [1,0,0,0,1,0|2,0,0]=4 163 B7R1.1 NCC1=CNC=N1 3H30-1-JQ [1,0,0,0,1,0|1,0,1]=4 164 B7R1.1 NCC1=NC=CO1 4H30-5-54 [1,0,0,0,1,0|2,0,0]=4 165 B7R1.1 NCC1=NNC=N1 3H30-1-JP [1,0,0,0,1,0|2,0,0]=4 166 B7R1.1 OCC1=NC=CN1 4H01-1-0W [1,0,0,0,1,0|1,0,1]=4