0 B7R1.2 BrC1=CC=C(I)S1 5H66-S-00 [0,0,0,0,0,0|3,0,0]=3 1 B7R1.2 CC1=CN=C(I)N1 3H32-H-18 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.2 CC1=NSC(I)=C1 7H70-H-01 [0,0,0,0,0,0|4,0,0]=4 3 B7R1.2 CC1CCC(C)N1 3H31-5-0R [0,0,0,0,0,0|0,0,4]=4 4 B7R1.2 CC1CNC(=S)N1 7H67-1-34 [0,0,0,0,0,0|2,0,2]=4 5 B7R1.2 CC1COC(=O)N1 4H56-1-0P2 [0,0,0,0,0,0|2,0,2]=4 6 B7R1.2 NC1=CSC(Cl)=C1 7H66-5-73 [0,0,0,0,0,0|4,0,0]=4 7 B6R1.2 CC1=CNN=N1 3H32-1-W2 [1,0,0,0,0,0|2,0,1]=4 8 B6R1.2 ClC1=CC=CO1 2H10-5-0M [1,0,0,0,0,0|2,0,0]=3 9 B6R1.2 ClC1=NSC=C1 7H70-5-2G [1,0,0,0,0,0|2,0,1]=4 10 B6R1.2 FC1=NNC=C1 3H31-3-61 [1,0,0,0,0,0|2,0,1]=4 11 B6R1.2 IC1=NC=CO1 4H56-H-42 [1,0,0,0,0,0|2,0,1]=4 12 B8R1.1 CC1=CC=C(C=O)N1 4H15-1-7U [0,1,0,0,0,0|0,0,1]=2 13 B8R1.1 CC1=CN=C(C=O)S1 8H70-1-Y8 [0,1,0,0,0,0|2,0,1]=4 14 B8R1.1 CC1=CNC(C=O)=C1 4H15-1-4K [0,1,0,0,0,0|2,0,1]=4 15 B8R1.1 CC1=CNC(C=O)=N1 4H15-1-7G [0,1,0,0,0,0|1,0,2]=4 16 B8R1.1 CC1=NC=C(CO)O1 4H01-1-5U [0,1,0,0,0,0|2,0,0]=3 17 B8R1.1 CC1=NNC(CCl)=C1 3H31-5-1Y [0,1,0,0,0,0|3,0,0]=4 18 B8R1.1 CCN1C=CC(Br)=N1 3H32-9-8A [0,1,0,0,0,0|2,0,1]=4 19 B8R1.1 CN1C=NC(CN)=N1 3H30-1-KE [0,1,0,0,0,0|2,0,1]=4 20 B8R1.1 ClCC1=CC=C(Cl)S1 5H66-5-12 [0,1,0,0,0,0|2,0,0]=3 21 B8R1.1 N#CC1=CC=C(Br)O1 4H37-9-09 [0,1,0,0,0,0|2,0,1]=4 22 B8R1.1 N#CC1=CC=C(O)S1 8H37-1-0A [0,1,0,0,0,0|2,0,1]=4 23 B8R1.1 NCC1=CC(Cl)=CS1 7H66-5-78 [0,1,0,0,0,0|3,0,0]=4 24 B8R1.1 NCC1=CC=C(Br)O1 4H56-9-8P [0,1,0,0,0,0|2,0,0]=3 25 B8R1.1 NCC1=NC=C(Br)S1 7H70-D-0A [0,1,0,0,0,0|3,0,0]=4 26 B8R1.1 O=CC1=CC=C(O)S1 6H15-1-0H [0,1,0,0,0,0|2,0,1]=4 27 B8R1.18 CC1=C(C)SC(Cl)=N1 7H70-5-0W [0,1,0,0,0,0|2,0,1]=4 28 B8R1.18 CC1=CC(I)=C(C)S1 5H66-H-06 [0,1,0,0,0,0|1,0,0]=2 29 B8R1.18 CC1=NN(C)C=C1Cl 3H32-5-UL [0,1,0,0,0,0|1,0,1]=3 30 B8R1.18 CC1=NN(C)C=C1O 4H01-1-DT [0,1,0,0,0,0|1,0,1]=3 31 B8R1.18 CN1C=C(N)C(Cl)=N1 3H30-5-8X [0,1,0,0,0,0|2,0,1]=4 32 B8R1.18 CN1N=C(Cl)C=C1N 3H30-5-4B [0,1,0,0,0,0|2,0,1]=4 33 B8R1.18 C[C@@H]1NC(=O)OC1=O 4H56-1-S0C [0,1,0,0,0,0|2,0,1]=4 34 B8R1.50 CC1=C(N)N(C)N=C1 3H30-1-0A [0,1,0,0,0,0|3,0,0]=4 35 B8R1.50 CC1=NOC(C)=C1Cl 4H47-5-0W [0,1,0,0,0,0|3,0,0]=4 36 B8R1.50 CC1=NOC(C)=C1O 4H01-1-D4 [0,1,0,0,0,0|3,0,0]=4 37 B8R1.3 CC1=CN=C(N)N=C1 3H30-1-NX [0,0,0,0,0,1|2,0,1]=4 38 B8R1.3 NC1=CC=C(N)N=N1 3H30-1-0K [0,0,0,0,0,1|2,0,1]=4 39 B8R1.4 CC1=CC=CC(I)=N1 3H32-H-67 [0,0,0,0,0,1|1,0,1]=3 40 B8R1.4 CC1=CN=NC(N)=C1 3H30-1-M5 [0,0,0,0,0,1|3,0,0]=4 41 B8R1.4 CC1=NC(N)=CC=N1 3H30-1-39 [0,0,0,0,0,1|1,0,1]=3 42 B8R1.4 CC1=NC=NC(N)=C1 3H30-1-81 [0,0,0,0,0,1|3,0,0]=4 43 B8R1.4 ClC1=CC=NC(I)=N1 3H32-M-3Q [0,0,0,0,0,1|2,0,1]=4 44 B8R1.4 OC1=CC=CC(Br)=N1 4H01-9-0E [0,0,0,0,0,1|2,0,1]=4 45 B5R0.1 C=CCC(C)N 3230-5-0A [1,0,1,0,0,0|0,0,2]=4 46 B7R0.4 C\C=C\C=C\C(C)=O 2317-1-0E [0,1,1,0,0,0|1,0,0]=3 47 B7R1.1 CCC1=CSC=N1 7H70-1-2D [1,1,0,0,0,0|1,0,1]=4 48 B7R1.1 ClCC1=NC=CS1 7H70-5-0G [1,1,0,0,0,0|1,0,1]=4 49 B7R1.1 NCC1=CNC=N1 3H30-1-JQ [1,1,0,0,0,0|1,0,1]=4 50 B7R1.1 NCC1=NC=CO1 4H30-5-54 [1,1,0,0,0,0|1,0,1]=4 51 B7R1.1 OCC1=NC=CN1 4H01-1-0W [1,1,0,0,0,0|1,0,0]=3 52 B7R1.4 CC1=C(Br)C=NO1 4H44-9-01 [1,1,0,0,0,0|2,0,0]=4 53 B7R1.4 CC1=C(O)C=CS1 6H61-1-03 [1,1,0,0,0,0|1,0,0]=3 54 B7R1.4 CC1=CSC=C1O 6H01-1-0M [1,1,0,0,0,0|2,0,0]=4 55 B7R1.4 CN1C=CC=C1Cl 3H32-5-UX [1,1,0,0,0,0|1,0,0]=3 56 B9R1.1 CC1=CC=C(CCl)N=C1 3H32-5-CY [0,1,0,0,0,1|0,0,1]=3 57 B9R1.1 CC1=CC=C(CN)N=N1 3H30-5-3Z [0,1,0,0,0,1|0,0,1]=3 58 B9R1.1 CCC1=CC=C(Br)N=C1 3H32-9-5W [0,1,0,0,0,1|1,0,1]=4 59 B9R1.1 CCC1=NNC(=O)C=C1 4H48-1-08A [0,1,0,0,0,1|1,0,0]=3 60 B9R1.1 CNC1=CC=C(Br)N=C1 3H31-9-0Z [0,1,0,0,0,1|1,0,1]=4 61 B9R1.1 CNC1=CC=C(F)C=N1 3H32-3-6Y [0,1,0,0,0,1|1,0,1]=4 62 B9R1.1 CNC1=CC=C(F)C=N1 3H32-7-5E [0,1,0,0,0,1|1,0,1]=4 63 B9R1.1 COC1=CC=C(I)N=N1 4H07-H-03 [0,1,0,0,0,1|1,0,1]=4 64 B9R1.1 COC1=CN=C(O)C=C1 4H07-1-6A [0,1,0,0,0,1|1,0,1]=4 65 B9R1.1 CSC1=CC=C(O)C=N1 8H66-1-AP [0,1,0,0,0,1|1,0,1]=4 66 B9R1.1 FC1=CC=C(CBr)N=C1 3H32-B-2G [0,1,0,0,0,1|1,0,1]=4 67 B9R1.1 NCC1=CC=C(F)C=N1 3H30-7-71 [0,1,0,0,0,1|1,0,1]=4 68 B9R1.1 NCC1=CC=C(N)C=N1 3H30-1-JC [0,1,0,0,0,1|1,0,1]=4 69 B9R1.1 NCC1=CC=C(N)N=C1 3H30-1-Y2 [0,1,0,0,0,1|1,0,1]=4 70 B9R1.1 OCC1=CC=C(Cl)N=N1 4H01-5-0V [0,1,0,0,0,1|1,0,1]=4 71 B9R1.69 CC1=C(N)C=CC(=O)N1 4H30-1-8W [0,1,0,0,0,1|2,0,0]=4 72 B9R1.69 CC1=CC(=O)NN=C1C 4H48-1-05D [0,1,0,0,0,1|1,0,0]=3 73 B9R1.69 CC1=CC=C(Br)N=C1N 3H30-9-93 [0,1,0,0,0,1|1,0,1]=4 74 B9R1.69 CC1=CC=C(Cl)C(F)=N1 3H32-7-C1 [0,1,0,0,0,1|1,0,1]=4 75 B9R1.69 CC1=CC=C(F)N=C1Br 3H32-B-6N [0,1,0,0,0,1|1,0,1]=4 76 B9R1.69 O=C1C=C(I)C(F)=CN1 4H48-K-00 [0,1,0,0,0,1|2,0,0]=4 77 B9R1.69 O=C1NC=C(F)C=C1Br 4H17-B-04 [0,1,0,0,0,1|2,0,0]=4 78 B9R1.2 CC1=CN=CC(CN)=C1 3H30-1-9X [0,1,0,0,0,1|1,0,0]=3 79 B9R1.2 CC1=CN=NC(CN)=C1 3H30-5-9A [0,1,0,0,0,1|2,0,0]=4 80 B9R1.2 CNC1=CC(Br)=CC=N1 3H31-9-18 [0,1,0,0,0,1|2,0,0]=4 81 B9R1.2 CNC1=CC(Cl)=CC=N1 3H31-5-5V [0,1,0,0,0,1|2,0,0]=4 82 B9R1.2 CNC1=CC=NC(Br)=C1 3H31-9-17 [0,1,0,0,0,1|2,0,0]=4 83 B9R1.2 CNC1=CN=CC(Br)=C1 2H31-9-00 [0,1,0,0,0,1|2,0,0]=4 84 B9R1.2 CNC1=NC=CC(Cl)=N1 3H31-5-2Z [0,1,0,0,0,1|1,0,1]=4 85 B9R1.2 COC1=CC(F)=NC=C1 4H07-3-0Y [0,1,0,0,0,1|2,0,0]=4 86 B9R1.2 COC1=CC=CC(O)=N1 4H07-1-4R [0,1,0,0,0,1|1,0,1]=4 87 B9R1.2 COC1=CC=NC(C)=C1 4H56-1-282 [0,1,0,0,0,1|1,0,0]=3 88 B9R1.2 COC1=CN=CC(F)=C1 4H06-3-00 [0,1,0,0,0,1|2,0,0]=4 89 B9R1.2 CSC1=CN=CC(O)=C1 8H66-1-AQ [0,1,0,0,0,1|2,0,0]=4 90 B9R1.2 CSC1=NC(Cl)=CC=C1 8H66-5-4P [0,1,0,0,0,1|1,0,1]=4 91 B9R1.2 ClCC1=CC=CC(Cl)=N1 3H32-5-JS [0,1,0,0,0,1|1,0,1]=4 92 B9R1.2 FC1=CN=CC(CBr)=C1 3H32-B-75 [0,1,0,0,0,1|2,0,0]=4 93 B9R1.2 NCC1=CC=CC(Br)=N1 3H30-D-21 [0,1,0,0,0,1|1,0,1]=4 94 B9R1.2 NCC1=CC=CC(N)=N1 3H30-1-JL [0,1,0,0,0,1|1,0,1]=4 95 B9R1.2 NCC1=CC=NC(N)=C1 3H30-5-6M [0,1,0,0,0,1|2,0,0]=4 96 B9R1.2 NCC1=NC=CC(F)=N1 3H30-3-0J [0,1,0,0,0,1|1,0,1]=4 97 B9R1.2 OCC1=CC=CC(S)=C1 6661-1-00 [0,1,0,0,0,1|2,0,0]=4 98 B9R1.2 OCC1=CN=CC(O)=C1 4H56-1-0LK [0,1,0,0,0,1|2,0,0]=4 99 B9R1.34 CC1=CC(Br)=CC(O)=N1 4H01-9-0N [0,1,0,0,0,1|1,0,1]=4 100 B9R1.34 CC1=CC(F)=CC(Cl)=C1 1700-7-Z0 [0,1,0,0,0,1|2,0,0]=4 101 B9R1.34 CC1=CC(F)=CC(O)=N1 4H01-3-43 [0,1,0,0,0,1|1,0,1]=4 102 B9R1.34 CC1=CC(N)=NC(C)=N1 3H30-1-0U [0,1,0,0,0,1|0,0,1]=3 103 B9R1.34 CC1=CC(N)=NC(N)=N1 3H30-1-0P [0,1,0,0,0,1|1,0,1]=4 104 B9R1.34 CC1=NC(C)=NC(Br)=C1 3H32-9-74 [0,1,0,0,0,1|0,0,1]=3 105 B9R1.34 NC1=NC(S)=CC(=O)N1 8H61-1-02 [0,1,0,0,0,1|2,0,0]=4 106 B9R1.34 O=C1C=C(Cl)NC(Cl)=N1 4H56-5-36 [0,1,0,0,0,1|2,0,0]=4 107 B9R1.7 CCCC1=CC=C(Br)S1 5H66-9-26 [0,2,0,0,0,0|2,0,0]=4 108 B9R1.7 CNCC1=NN(C)C=C1 3H31-1-83 [0,2,0,0,0,0|1,0,1]=4 109 B9R1.21 O=CC1=CC=C(CCl)O1 2H15-5-08 [0,2,0,0,0,0|1,0,1]=4 110 B9R1.22 CC1=CC(C)=C(CN)N1 3H30-1-JM [0,2,0,0,0,0|0,0,0]=2 111 B9R1.22 CC1=NC(C)=C(CN)S1 7H70-1-52 [0,2,0,0,0,0|1,0,1]=4 112 B9R1.22 CC1=NC(CN)=C(C)O1 4H56-1-4U [0,2,0,0,0,0|1,0,1]=4 113 B9R1.22 CN1C=C(Br)C(CN)=N1 3H30-9-38 [0,2,0,0,0,0|1,0,1]=4 114 B9R1.23 CCC1=NN(C)C(Cl)=C1 3H32-5-LK [0,2,0,0,0,0|1,0,1]=4 115 B9R1.23 CCC1=NN(C)C(O)=C1 4H01-1-9H [0,2,0,0,0,0|1,0,1]=4 116 B9R1.35 CC(=O)C1=CC=C(Br)O1 2H17-9-30 [0,2,0,0,0,0|2,0,0]=4 117 B9R1.35 CC(N)C1=NN(C)C=C1 3H30-1-91 [0,2,0,0,0,0|1,0,1]=4 118 B9R1.35 CC1=CSC(C(F)F)=C1 5H66-3-06 [0,2,0,0,0,0|2,0,0]=4 119 B9R1.35 CC1=CSC(C(F)F)=N1 7H70-3-21 [0,2,0,0,0,0|1,0,1]=4 120 B9R1.35 CC1=NC(C(C)N)=CS1 7H30-1-0E [0,2,0,0,0,0|1,0,1]=4 121 B9R1.35 CC1=NC(C(F)F)=CN1 3H31-3-5S [0,2,0,0,0,0|1,0,1]=4 122 B9R1.35 CC1=NC(C(F)F)=CS1 7H70-3-23 [0,2,0,0,0,0|1,0,1]=4 123 B9R1.35 FC(F)C1=CC=C(Cl)S1 5H66-7-00 [0,2,0,0,0,0|2,0,0]=4 124 B9R1.35 FC(F)C1=CC=C(I)S1 5H66-K-02 [0,2,0,0,0,0|2,0,0]=4 125 B9R1.37 CC1=C(C)N(C)C(Br)=N1 3H32-9-7K [0,2,0,0,0,0|2,0,0]=4 126 B9R1.37 CC1=NN(C)C(C)=C1Cl 3H32-5-UM [0,2,0,0,0,0|1,0,1]=4