0 B7R1.2 BrC1=CSC(Br)=C1 CC28510 [0,0,0,0,0,0|4,0,0]=4 1 B7R1.2 CC1=CC(C)=NO1 TL00573 [0,0,0,0,0,0|3,0,0]=3 2 B7R1.2 CC1=COC(N)=N1 KM08202 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.2 CC1=NC(I)=CN1 MO00831 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.2 CN1C=CC(Cl)=N1 MO08357 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.2 CN1C=CC(I)=N1 CC48311 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.2 CN1C=CC(N)=N1 GK00321 [0,0,0,0,0,0|3,0,0]=3 7 B6R1.2 BrC1=CC=CO1 CC02010 [1,0,0,0,0,0|1,0,0]=2 8 B6R1.2 ClC1=NC=CS1 MO07794 [1,0,0,0,0,0|2,1,0]=4 9 B6R1.2 IC1=NNC=C1 NP44481 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.1 CC1=CC(CBr)=NO1 CC10408 [0,1,0,0,0,0|3,0,0]=4 11 B8R1.1 CC1=CC(CCl)=NO1 SPB01262 [0,1,0,0,0,0|3,0,0]=4 12 B8R1.1 CC1=CC(CN)=NO1 CC10413 [0,1,0,0,0,0|3,0,0]=4 13 B8R1.1 CC1=CC(CO)=NO1 CC10409 [0,1,0,0,0,0|3,0,0]=4 14 B8R1.1 CC1=CC=C(C#N)S1 CC65016 [0,1,0,0,0,0|0,1,1]=3 15 B8R1.1 CC1=CC=C(CN)S1 CC65063 [0,1,0,0,0,0|0,1,0]=2 16 B8R1.1 CC1=CSC(C=O)=N1 NP42935 [0,1,0,0,0,0|2,0,1]=4 17 B8R1.1 CC1=CSC(CN)=C1 CC30613 [0,1,0,0,0,0|2,0,0]=3 18 B8R1.1 CC1=NC(C=O)=CN1 SB01361 [0,1,0,0,0,0|2,0,1]=4 19 B8R1.1 CC1=NC(C=O)=CO1 CC57904 [0,1,0,0,0,0|2,0,1]=4 20 B8R1.1 CC1=NC(C=O)=CS1 CC05704 [0,1,0,0,0,0|2,0,1]=4 21 B8R1.1 CC1=NC(CCl)=CS1 CD09497 [0,1,0,0,0,0|2,0,0]=3 22 B8R1.1 CC1=NC(CN)=CS1 CC05713 [0,1,0,0,0,0|2,0,0]=3 23 B8R1.1 CC1=NC(CO)=CS1 CC05709 [0,1,0,0,0,0|2,0,0]=3 24 B8R1.1 CC1=NOC(CN)=C1 CC27013 [0,1,0,0,0,0|3,0,0]=4 25 B8R1.1 CC1=NOC(CO)=C1 CC27009 [0,1,0,0,0,0|3,0,0]=4 26 B8R1.1 CN1C=CC(CO)=N1 CC48309 [0,1,0,0,0,0|2,0,0]=3 27 B8R1.1 CN1C=NC(CN)=C1 CC03613 [0,1,0,0,0,0|3,0,0]=4 28 B8R1.1 O=CC1=CC=C(Cl)S1 SEW03796 [0,1,0,0,0,0|1,1,1]=4 29 B8R1.1 OCC1=CC(Br)=CS1 CC28509 [0,1,0,0,0,0|3,0,0]=4 30 B8R1.18 CC1=NC(C)=C(Br)S1 CC05810 [0,1,0,0,0,0|2,0,0]=3 31 B8R1.18 CC1=NN(C)C(N)=C1 KM00001 [0,1,0,0,0,0|2,0,0]=3 32 B8R1.18 CN1C=C(Br)C(N)=N1 GK00323 [0,1,0,0,0,0|3,0,0]=4 33 B8R1.50 CC1=NC=C(Br)N1C CC25110 [0,1,0,0,0,0|3,0,0]=4 34 B8R1.50 CC1=NN=C(C)N1N CD08995 [0,1,0,0,0,0|3,0,0]=4 35 B8R1.50 CC1=NOC(C)=C1Br CC00610 [0,1,0,0,0,0|3,0,0]=4 36 B8R1.3 CC1=CN=C(N)C=N1 MO08458 [0,0,0,0,0,1|3,0,0]=4 37 B8R1.3 CC1=CN=C(O)C=C1 AC35768 [0,0,0,0,0,1|2,0,0]=3 38 B8R1.3 CC1=NNC(=O)C=C1 BTB06840 [0,0,0,0,0,1|2,0,0]=3 39 B8R1.3 NC1=CC=C(Br)N=N1 MO07086 [0,0,0,0,0,1|3,0,0]=4 40 B8R1.3 NC1=CC=C(Cl)N=N1 BTB05877 [0,0,0,0,0,1|3,0,0]=4 41 B8R1.4 BrC1=CC=CC(Br)=N1 SB01233 [0,0,0,0,0,1|3,0,0]=4 42 B8R1.4 CC1=CC(Cl)=NC=N1 NP45412 [0,0,0,0,0,1|3,0,0]=4 43 B8R1.4 CC1=CN=CC(Cl)=N1 MO07699 [0,0,0,0,0,1|2,0,0]=3 44 B8R1.4 ClC1=CC=CC(I)=C1 TL00516 [0,0,0,0,0,1|3,0,0]=4 45 B8R1.4 FC1=NC=CC(I)=C1 MO07994 [0,0,0,0,0,1|3,0,0]=4 46 B8R1.4 NC1=CC=NC(Br)=C1 NP43741 [0,0,0,0,0,1|3,0,0]=4 47 B8R1.4 NC1=CC=NC(O)=C1 NP43208 [0,0,0,0,0,1|3,0,0]=4 48 B8R1.4 O=C1C=C(I)C=CN1 MO07919 [0,0,0,0,0,1|3,0,0]=4 49 B8R1.4 OC1=CC(Br)=CC=N1 NP43209 [0,0,0,0,0,1|3,0,0]=4 50 B8R1.4 OC1=CC(Cl)=CN=C1 SB00891 [0,0,0,0,0,1|3,0,0]=4 51 B5R0.3 C\C(C=O)=C/N RH01431 [1,0,1,0,0,0|2,0,0]=4 52 B7R0.4 CCO\C=C\C(=O)O RH00924 [0,1,1,0,0,0|1,0,1]=4 53 B7R1.1 C#CC1=CC=CS1 CC13047 [1,1,0,0,0,0|0,1,1]=4 54 B7R1.1 NCC1=CN=CS1 MO08602 [1,1,0,0,0,0|1,1,0]=4 55 B7R1.1 NCC1=CSC=C1 CC13113 [1,1,0,0,0,0|2,0,0]=4 56 B7R1.1 NCC1=NC=CS1 CC09513 [1,1,0,0,0,0|1,1,0]=4 57 B7R1.1 O=CC1=CC=CN1 CC08704 [1,1,0,0,0,0|1,0,1]=4 58 B7R1.1 OCC1=NC=CN1 CC08909 [1,1,0,0,0,0|2,0,0]=4 59 B7R1.1 OCC1=NC=CS1 CC09509 [1,1,0,0,0,0|1,1,0]=4 60 B7R1.4 CC1=C(I)C=NO1 CC26311 [1,1,0,0,0,0|1,0,0]=3 61 B7R1.4 CN1N=CC=C1I CC62311 [1,1,0,0,0,0|2,0,0]=4 62 B7R1.4 CN1N=CC=C1N GK03066 [1,1,0,0,0,0|2,0,0]=4 63 B7R1.4 ClC1=C(Br)C=CS1 AC25875 [1,1,0,0,0,0|1,1,0]=4 64 B9R1.1 CC1=CC=C(CS)C=C1 TL00457 [0,1,0,0,0,1|1,0,0]=3 65 B9R1.1 COC1=CC=C(I)C=N1 NP43893 [0,1,0,0,0,1|2,0,0]=4 66 B9R1.1 NC1=CC=C(CO)C=N1 MO07396 [0,1,0,0,0,1|2,0,0]=4 67 B9R1.1 OCC1=CC=C(Cl)C=C1 SB01197 [0,1,0,0,0,1|2,0,0]=4 68 B9R1.1 OCC1=NC=C(Br)C=C1 MO07897 [0,1,0,0,0,1|2,0,0]=4 69 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 MO07184 [0,1,0,0,0,1|2,0,0]=4 70 B9R1.69 CC1=CC(Br)=C(N)N=C1 XBX00111 [0,1,0,0,0,1|2,0,0]=4 71 B9R1.69 CC1=CC=C(O)C(C)=N1 RH01494 [0,1,0,0,0,1|2,0,0]=4 72 B9R1.2 CC1=CC=CC(CS)=C1 TL00469 [0,1,0,0,0,1|1,0,0]=3 73 B9R1.2 CC1=NC(CO)=CC=C1 RJC03579 [0,1,0,0,0,1|1,0,0]=3 74 B9R1.2 CCC1=CC=CC(Br)=C1 TL00571 [0,1,0,0,0,1|2,0,0]=4 75 B9R1.2 CNC1=CC(Cl)=CC=C1 TL00250 [0,1,0,0,0,1|2,0,0]=4 76 B9R1.2 COC1=CC=CC(N)=N1 MO08464 [0,1,0,0,0,1|2,0,0]=4 77 B9R1.2 ClCC1=CC(Br)=CN=C1 CC67174 [0,1,0,0,0,1|2,0,0]=4 78 B9R1.2 OCC1=CC(Cl)=CC=C1 SB01130 [0,1,0,0,0,1|2,0,0]=4 79 B9R1.2 OCC1=CC(Cl)=NC=C1 CC53609 [0,1,0,0,0,1|2,0,0]=4 80 B9R1.2 OCC1=CC=NC(F)=C1 NP45237 [0,1,0,0,0,1|2,0,0]=4 81 B9R1.3 CC1=CC=CC(C)=C1F CD05584 [0,1,0,0,0,1|1,0,0]=3 82 B9R1.3 CC1=CC=CC(N)=C1N BTB07447 [0,1,0,0,0,1|2,0,0]=4 83 B9R1.34 CC1=CC(C)=CC(F)=C1 HAN00040 [0,1,0,0,0,1|1,0,0]=3 84 B9R1.34 CC1=CC(Cl)=CC(C)=N1 MAY00207 [0,1,0,0,0,1|1,0,0]=3 85 B9R1.34 CC1=NC(C)=NC(N)=N1 RF02292 [0,1,0,0,0,1|2,0,0]=4 86 B9R1.7 CC1=CSC(CC#N)=N1 SB02109 [0,2,0,0,0,0|2,0,0]=4 87 B9R1.7 CC1=NC(CCN)=CS1 CC54613 [0,2,0,0,0,0|2,0,0]=4 88 B9R1.7 CC1=NC(CCO)=CS1 CC54609 [0,2,0,0,0,0|2,0,0]=4 89 B9R1.7 CNCC1=CC(C)=CS1 CC30646 [0,2,0,0,0,0|2,0,0]=4 90 B9R1.7 CNCC1=CC=C(C)S1 CC65096 [0,2,0,0,0,0|0,1,0]=3 91 B9R1.7 CNCC1=COC(C)=N1 CC57946 [0,2,0,0,0,0|2,0,0]=4 92 B9R1.7 CNCC1=CSC(C)=N1 CC05746 [0,2,0,0,0,0|2,0,0]=4 93 B9R1.21 CSC1=CC=C(C=O)S1 SEW03493 [0,2,0,0,0,0|0,1,1]=4 94 B9R1.22 CC1=CC(C)=C(C=O)N1 CC18004 [0,2,0,0,0,0|1,0,1]=4 95 B9R1.22 CC1=NN(C)C(C=O)=C1 CC12504 [0,2,0,0,0,0|2,0,0]=4 96 B9R1.22 CC1=NN(C)C(CCl)=C1 CC12524 [0,2,0,0,0,0|2,0,0]=4 97 B9R1.22 CC1=NN(C)C(CO)=C1 CC12509 [0,2,0,0,0,0|2,0,0]=4 98 B9R1.22 CN1C=C(Br)C(CCl)=N1 CC63924 [0,2,0,0,0,0|2,0,0]=4 99 B9R1.22 CN1C=C(Br)C(CO)=N1 CC63909 [0,2,0,0,0,0|2,0,0]=4 100 B9R1.23 CC1=C(C)OC(C=O)=C1 BTB08889 [0,2,0,0,0,0|0,0,1]=3 101 B9R1.23 CC1=CC(CO)=NN1C CC12609 [0,2,0,0,0,0|2,0,0]=4 102 B9R1.35 CC1=CC=C(C(=O)Cl)S1 CC65002 [0,2,0,0,0,0|0,1,1]=4 103 B9R1.132 CC1=CC=C(CN)N1C SP01447 [0,2,0,0,0,0|1,0,0]=3 104 B9R1.27 CC1=COC(C)=C1C=O CC65804 [0,2,0,0,0,0|2,0,0]=4