0 B8R1.3 CC1=CN=C(N)C=N1 MO08458 [0,0,0,0,0,0|3,0,0]=3 1 B8R1.3 CC1=CN=C(O)C=C1 AC35768 [0,0,0,0,0,0|1,0,0]=1 2 B8R1.3 CC1=NNC(=O)C=C1 BTB06840 [0,0,0,0,0,0|2,0,1]=3 3 B8R1.3 NC1=CC=C(Br)N=N1 MO07086 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.3 NC1=CC=C(Cl)N=N1 BTB05877 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.3 NC1=CN=C(Cl)N=C1 NP43432 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.3 NC1=NC=C(Br)N=C1 MO00943 [0,0,0,0,0,0|4,0,0]=4 7 B7R1.3 IC1=CC=NC=C1 MO00014 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.1 CC1=CC=C(CS)C=C1 TL00457 [0,1,0,0,0,0|0,1,0]=2 9 B9R1.1 COC1=CC=C(I)C=N1 NP43893 [0,1,0,0,0,0|2,0,0]=3 10 B9R1.1 NC1=CC=C(CO)C=N1 MO07396 [0,1,0,0,0,0|2,0,0]=3 11 B9R1.1 NNC1=CC=C(I)C=C1 RF01374 [0,1,0,0,0,0|2,0,0]=3 12 B9R1.1 O=CC1=CC=C(Br)C=C1 SB01132 [0,1,0,0,0,0|1,0,1]=3 13 B9R1.1 OCC1=CC=C(Cl)C=C1 SB01197 [0,1,0,0,0,0|1,0,0]=2 14 B9R1.1 OCC1=NC=C(Br)C=C1 MO07897 [0,1,0,0,0,0|2,0,0]=3 15 B9R1.69 CC1=C(N)N=CC(Br)=C1 XBX00112 [0,1,0,0,0,0|3,0,0]=4 16 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 MO07184 [0,1,0,0,0,0|2,0,0]=3 17 B9R1.69 CC1=CC(Br)=C(N)N=C1 XBX00111 [0,1,0,0,0,0|2,0,0]=3 18 B9R1.69 CC1=CC=C(O)C(C)=N1 RH01494 [0,1,0,0,0,0|1,0,0]=2 19 B9R1.69 CC1=CN=C(Cl)C(C)=N1 MO08011 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.69 CC1=CN=C(N)C(C)=N1 BTB07911 [0,1,0,0,0,0|3,0,0]=4 21 B9R1.69 CC1=NC(N)=CC=C1Br XBX00110 [0,1,0,0,0,0|3,0,0]=4 22 B9R1.69 ClC1=C(Cl)C=C(I)C=C1 BTB06155 [0,1,0,0,0,0|2,0,0]=3 23 B9R1.69 ClC1=CC(Cl)=C(I)C=C1 TL00185 [0,1,0,0,0,0|2,0,0]=3 24 B9R1.69 FC1=C(F)C=C(Cl)C=C1 SB01824 [0,1,0,0,0,0|2,0,0]=3 25 B9R1.69 FC1=C(F)C=C(I)C=C1 SB01245 [0,1,0,0,0,0|2,0,0]=3 26 B9R1.69 FC1=CC(Cl)=C(I)C=C1 TL00223 [0,1,0,0,0,0|2,0,0]=3 27 B9R1.69 FC1=CC=C(S)C=C1Cl TL00315 [0,1,0,0,0,0|1,1,0]=3 28 B9R1.69 NC1=CC(Cl)=CN=C1Cl SPB06843 [0,1,0,0,0,0|3,0,0]=4 29 B9R1.69 NC1=CC=C(Cl)N=C1Cl RF05052 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.69 NC1=NC=C(Br)C=C1Br BTB07310 [0,1,0,0,0,0|3,0,0]=4 31 B9R1.69 OC1=CC(F)=C(F)C=C1 SB01786 [0,1,0,0,0,0|1,0,0]=2 32 B7R1.2 BrC1=CSC(Br)=C1 CC28510 [0,0,0,0,1,0|3,0,0]=4 33 B7R1.2 CC1=CC(C)=NO1 TL00573 [0,0,0,0,1,0|3,0,0]=4 34 B7R1.2 CC1=COC(N)=N1 KM08202 [0,0,0,0,1,0|3,0,0]=4 35 B7R1.2 CC1=NC(I)=CN1 MO00831 [0,0,0,0,1,0|3,0,0]=4 36 B7R1.2 CN1C=CC(Cl)=N1 MO08357 [0,0,0,0,1,0|3,0,0]=4 37 B7R1.2 CN1C=CC(I)=N1 CC48311 [0,0,0,0,1,0|3,0,0]=4 38 B7R1.2 CN1C=CC(N)=N1 GK00321 [0,0,0,0,1,0|3,0,0]=4 39 B8R1.2 ClCC1=NC=CC=N1 MAY00188 [1,1,0,0,0,0|2,0,0]=4 40 B8R1.2 OCC1=NC=CN=C1 CC03409 [1,1,0,0,0,0|2,0,0]=4 41 B8R1.4 BrC1=CC=CC(Br)=N1 SB01233 [1,1,0,0,0,0|2,0,0]=4 42 B8R1.4 CC1=CC(Cl)=NC=N1 NP45412 [1,1,0,0,0,0|2,0,0]=4 43 B8R1.4 CC1=CN=CC(Cl)=N1 MO07699 [1,1,0,0,0,0|2,0,0]=4 44 B8R1.4 ClC1=CC=CC(I)=C1 TL00516 [1,1,0,0,0,0|1,0,0]=3 45 B8R1.4 FC1=NC=CC(I)=C1 MO07994 [1,1,0,0,0,0|2,0,0]=4 46 B8R1.4 NC1=CC=NC(Br)=C1 NP43741 [1,1,0,0,0,0|2,0,0]=4 47 B8R1.4 NC1=CC=NC(O)=C1 NP43208 [1,1,0,0,0,0|1,0,0]=3 48 B8R1.4 O=C1C=C(I)C=CN1 MO07919 [1,1,0,0,0,0|1,0,1]=4 49 B8R1.4 OC1=CC(Br)=CC=N1 NP43209 [1,1,0,0,0,0|1,0,0]=3 50 B8R1.4 OC1=CC(Cl)=CN=C1 SB00891 [1,1,0,0,0,0|1,0,0]=3 51 B8R1.4 OC1=NC=NC(Cl)=C1 MO07170 [1,1,0,0,0,0|2,0,0]=4 52 B8R1.5 CC1=C(Br)C=CC=N1 NP43686 [1,1,0,0,0,0|1,0,0]=3 53 B8R1.5 CC1=C(N)C=CC=N1 NP43763 [1,1,0,0,0,0|1,0,0]=3 54 B8R1.5 CC1=CC=CNC1=O CD09405 [1,1,0,0,0,0|1,0,0]=3 55 B8R1.5 FC1=NC=CC=C1I MO00359 [1,1,0,0,0,0|2,0,0]=4 56 B8R1.1 CC1=CC(CO)=NO1 CC10409 [0,1,0,0,1,0|2,0,0]=4 57 B8R1.1 CC1=CC=C(C#N)S1 CC65016 [0,1,0,0,1,0|2,0,0]=4 58 B8R1.1 CC1=CC=C(CN)S1 CC65063 [0,1,0,0,1,0|2,0,0]=4 59 B8R1.1 CC1=CSC(CN)=C1 CC30613 [0,1,0,0,1,0|2,0,0]=4 60 B8R1.1 CC1=NC(CO)=CS1 CC05709 [0,1,0,0,1,0|2,0,0]=4 61 B8R1.1 CC1=NOC(CO)=C1 CC27009 [0,1,0,0,1,0|2,0,0]=4 62 B8R1.1 CN1C=CC(CO)=N1 CC48309 [0,1,0,0,1,0|2,0,0]=4 63 B8R1.1 OCC1=CC(Br)=CS1 CC28509 [0,1,0,0,1,0|2,0,0]=4 64 B10R1.1 CNCC1=CC=C(Cl)C=C1 MO00897 [0,2,0,0,0,0|1,0,0]=3 65 B10R1.1 CNCC1=NC=C(Br)C=C1 MO07896 [0,2,0,0,0,0|2,0,0]=4 66 B10R1.1 N#CCC1=CC=C(O)C=C1 SB00735 [0,2,0,0,0,0|0,0,0]=2 67 B10R1.1 OCCC1=CC=C(O)C=C1 SB01196 [0,2,0,0,0,0|0,0,0]=2 68 B10R1.1 S=C=NC1=CC=C(I)C=C1 S00350 [0,2,0,0,0,0|1,0,1]=4 69 B10R1.3 C#CC1=CC=C(CC)C=C1 BTB09906 [0,2,0,0,0,0|1,0,0]=3 70 B10R1.3 COC1=CC=C(C#N)C=N1 SPB04785 [0,2,0,0,0,0|1,0,1]=4 71 B10R1.3 O=CC1=CC=C(CBr)C=C1 MO07312 [0,2,0,0,0,0|0,0,1]=3 72 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 MO00162 [0,2,0,0,0,0|2,0,0]=4 73 B10R1.13 CC1=NC=C(C(=O)O)N=C1 SB01107 [0,2,0,0,0,0|2,0,0]=4 74 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 SPB06264 [0,2,0,0,0,0|1,0,1]=4 75 B10R1.25 CC1=CC(Cl)=CC=C1NN SB01504 [0,2,0,0,0,0|2,0,0]=4 76 B10R1.25 CC1=CC(N)=C(C#N)C=C1 TL00552 [0,2,0,0,0,0|1,0,0]=3 77 B10R1.25 CSC1=C(N)C=C(Cl)C=C1 CD05201 [0,2,0,0,0,0|1,0,0]=3 78 B10R1.25 FC1=C(CBr)C=CC(Cl)=C1 KM10077 [0,2,0,0,0,0|1,0,0]=3 79 B10R1.25 N#CC1=CC=C(Cl)C=C1Cl TL00187 [0,2,0,0,0,0|1,0,1]=4 80 B10R1.25 N#CC1=CC=C(O)C=C1F KM10855 [0,2,0,0,0,0|0,0,1]=3 81 B10R1.25 NNC1=CC=C(Cl)C=C1Cl BTB07732 [0,2,0,0,0,0|2,0,0]=4 82 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 TL00917 [0,2,0,0,0,0|1,0,0]=3 83 B10R1.176 OCC1=CC(O)=C(I)C=C1 MO07809 [0,2,0,0,0,0|1,0,0]=3 84 B10R1.22 CC1=C(N)C(N)=CC(Br)=C1 MO07383 [0,2,0,0,0,0|2,0,0]=4 85 B10R1.22 CC1=C(O)C(Cl)=CC(Br)=C1 SB01216 [0,2,0,0,0,0|1,0,0]=3 86 B10R1.22 CC1=CC(I)=CC(C)=C1O RDP00223 [0,2,0,0,0,0|1,0,0]=3 87 B10R1.22 ClC1=CC(Cl)=C(I)C(Cl)=C1 TL00270 [0,2,0,0,0,0|2,0,0]=4 88 B10R1.22 NC1=C(F)C=C(Br)C=C1Br BTB06640 [0,2,0,0,0,0|2,0,0]=4 89 B10R1.30 N#CC1=CC(Cl)=CC=C1Cl DP01309 [0,2,0,0,0,0|2,0,0]=4 90 B10R1.30 O=CC1=C(I)C=CC(O)=C1 MO07995 [0,2,0,0,0,0|1,0,0]=3 91 B10R1.118 CC1=C(Cl)C=C(N)C(N)=C1 TL00770 [0,2,0,0,0,0|1,0,0]=3 92 B10R1.118 CC1=CC(I)=C(C)C=C1I BTB13663 [0,2,0,0,0,0|1,0,0]=3 93 B10R1.118 CC1=CC(N)=C(C)C=C1Cl MAY00162 [0,2,0,0,0,0|1,0,0]=3 94 B10R1.118 CC1=NC(Cl)=C(Br)C=C1Br MAY00204 [0,2,0,0,0,0|2,0,0]=4 95 B6R1.2 BrC1=CC=CO1 CC02010 [1,0,0,0,1,0|2,0,0]=4