0 B9R1.23 CC1=C(C)SC(C=O)=N1 SC-48069 [0,0,0,0,0,0|1,1,1]=3 1 B9R1.23 CC1=C(C)SC(CN)=N1 SC-69259 [0,0,0,0,0,0|1,1,0]=2 2 B9R1.23 CC1=C(C)SC(CO)=N1 SC-72108 [0,0,0,0,0,0|1,1,0]=2 3 B9R1.23 CC1=CC(C#N)=NN1C SC-83232 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.23 CC1=CC(CO)=NN1C SC-84723 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.23 COC1=NC(C)=C(N)S1 SC-19291 [0,0,0,0,0,0|2,1,0]=3 6 B8R1.1 BrCC1=NC(Br)=NO1 SC-82985 [1,0,0,0,0,0|3,0,0]=4 7 B8R1.1 CC1=CC(CCl)=NO1 SC-03755 [1,0,0,0,0,0|3,0,0]=4 8 B8R1.1 CC1=CC(CN)=NO1 SC-67167 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.1 CC1=CC=C(CO)O1 SC-62862 [1,0,0,0,0,0|2,0,0]=3 10 B8R1.1 CC1=CNC(C=O)=N1 SC-52739 [1,0,0,0,0,0|2,0,1]=4 11 B8R1.1 CC1=CSC(C=O)=N1 SC-21023 [1,0,0,0,0,0|1,1,1]=4 12 B8R1.1 CC1=CSC(CN)=N1 SC-34738 [1,0,0,0,0,0|1,1,0]=3 13 B8R1.1 CC1=NC(CBr)=NO1 SC-51428 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.1 CC1=NC(CCl)=CS1 SC-13983 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.1 CC1=NC(CCl)=CS1 SC-45198 [1,0,0,0,0,0|3,0,0]=4 16 B8R1.1 CC1=NN=C(CCl)O1 SC-47984 [1,0,0,0,0,0|2,0,0]=3 17 B8R1.1 CC1=NN=C(CCl)S1 SC-93437 [1,0,0,0,0,0|2,1,0]=4 18 B8R1.1 CC1=NN=C(CN)O1 SC-89887 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.1 CCN1C=C(N)C=N1 SC-01313 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.1 CN1C=CC(CCl)=N1 SC-15542 [1,0,0,0,0,0|3,0,0]=4 21 B8R1.1 CN1C=CC(CN)=N1 SC-48429 [1,0,0,0,0,0|3,0,0]=4 22 B8R1.1 CN1C=CC(CO)=N1 SC-93682 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.1 CN1C=NC(CCl)=N1 SC-A3788 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.1 CN1C=NC(CO)=C1 SC-62822 [1,0,0,0,0,0|3,0,0]=4 25 B8R1.1 CN1C=NC(CO)=C1 SC-87077 [1,0,0,0,0,0|3,0,0]=4 26 B8R1.1 OCC1=NC(Br)=CO1 SC-89905 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.1 OCC1=NC=C(Br)S1 SC-00274 [1,0,0,0,0,0|2,1,0]=4 28 B8R1.18 CC1=C(Br)SC(N)=N1 SC-43964 [1,0,0,0,0,0|2,1,0]=4 29 B8R1.18 CC1=CC(=O)OC1=O SC-93924 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.18 CC1=CC(Br)=NN1C SC-99877 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.18 CC1=CC(N)=NN1C SC-51478 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.18 CC1=CN(C)N=C1N SC-49513 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.18 CC1=NC(C)=C(Br)S1 SC-03123 [1,0,0,0,0,0|1,1,0]=3 34 B8R1.18 CC1=NN(C)C(N)=C1 SC-03762 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.18 CC1=NN(C)C(O)=C1 SC-49399 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.18 CC1=NN(C)C=C1Br SC-93433 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.18 CC1=NN(C)C=C1N SC-48806 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.58 CC1=C(C)SC(C(=O)O)=N1 SC-72107 [0,1,0,0,0,0|1,1,1]=4 39 B8R0.19 CCC(=O)OC(=O)CC SC-26875 [0,0,1,0,0,0|2,0,1]=4 40 B10R1.8 CC1=CC(C)=CC(CBr)=C1 SC-03037 [0,0,0,0,0,1|3,0,0]=4 41 B10R1.8 CC1=CC(C)=NC(C#N)=N1 SC-69694 [0,0,0,0,0,1|2,0,1]=4 42 B10R1.8 CCC1=CC(Cl)=NC(N)=N1 SC-98286 [0,0,0,0,0,1|3,0,0]=4 43 B10R1.8 CCC1=CC(N)=NC(N)=N1 SC-86362 [0,0,0,0,0,1|3,0,0]=4 44 B10R1.8 COC1=CC(C)=CC(C)=C1 SC-11602 [0,0,0,0,0,1|3,0,0]=4 45 B10R1.8 COC1=NC(Cl)=NC(C)=C1 SC-24612 [0,0,0,0,0,1|3,0,0]=4 46 B10R1.8 COC1=NC(N)=NC(C)=N1 SC-26770 [0,0,0,0,0,1|3,0,0]=4 47 B10R1.8 CSC1=CC(C)=NC(Cl)=N1 SC-89699 [0,0,0,0,0,1|3,0,0]=4 48 B10R1.8 CSC1=NC(=O)C=C(C)N1 SC-41416 [0,0,0,0,0,1|3,0,0]=4 49 B10R1.8 CSC1=NC(C)=CC(Cl)=N1 SC-53913 [0,0,0,0,0,1|3,0,0]=4 50 B10R1.176 CCC1=CN=C(C)C(C)=N1 SC-78039 [0,0,0,0,0,1|1,0,0]=2 51 B10R1.176 COC1=CC=C(Br)C(C)=N1 SC-00681 [0,0,0,0,0,1|3,0,0]=4 52 B10R1.176 COC1=NC=C(Br)C(C)=C1 SC-01536 [0,0,0,0,0,1|3,0,0]=4 53 B10R1.176 CSC1=NC=C(C)C(O)=N1 SC-93103 [0,0,0,0,0,1|3,0,0]=4 54 B7R0.5 CCOC(=O)C(=N)N SC-32236 [1,0,1,0,0,0|2,0,0]=4 55 B7R0.5 CCOC(=O)C(C)=O SC-15232 [1,0,1,0,0,0|2,0,0]=4 56 B7R1.1 BrCC1=NC=CN1 SC-58221 [2,0,0,0,0,0|2,0,0]=4 57 B7R1.1 CCC1=CNC=N1 SC-83668 [2,0,0,0,0,0|2,0,0]=4 58 B7R1.1 CSC1=NC=CN1 SC-A2747 [2,0,0,0,0,0|2,0,0]=4 59 B7R1.1 ClCC1=NC=CO1 SC-48142 [2,0,0,0,0,0|1,0,0]=3 60 B7R1.1 ClCC1=NC=CS1 SC-82855 [2,0,0,0,0,0|1,1,0]=4 61 B7R1.1 NCC1=NC=CN1 SC-45619 [2,0,0,0,0,0|2,0,0]=4 62 B7R1.1 NCC1=NC=CN1 SC-66335 [2,0,0,0,0,0|2,0,0]=4 63 B7R1.1 NCC1=NC=CO1 SC-87169 [2,0,0,0,0,0|1,0,0]=3 64 B7R1.1 NCC1=NC=CS1 SC-49533 [2,0,0,0,0,0|1,1,0]=4 65 B7R1.1 O=CC1=NC=CO1 SC-14503 [2,0,0,0,0,0|1,0,1]=4 66 B7R1.1 OCC1=NC=CS1 SC-01144 [2,0,0,0,0,0|1,1,0]=4 67 B7R1.2 CC1=CC(C)=NN1 SC-22787 [2,0,0,0,0,0|2,0,0]=4 68 B7R1.2 CC1=CC(C)=NO1 SC-03263 [2,0,0,0,0,0|2,0,0]=4 69 B7R1.2 CC1=CC=C(Br)O1 SC-66940 [2,0,0,0,0,0|2,0,0]=4 70 B7R1.2 CC1=CN=C(Br)N1 SC-48712 [2,0,0,0,0,0|2,0,0]=4 71 B7R1.2 CC1=CN=C(Br)S1 SC-26052 [2,0,0,0,0,0|1,1,0]=4 72 B7R1.2 CC1=CN=C(N)N1 SC-13761 [2,0,0,0,0,0|2,0,0]=4 73 B7R1.2 CC1=CN=C(N)N1 SC-13762 [2,0,0,0,0,0|2,0,0]=4 74 B7R1.2 CC1=CN=C(N)N1 SC-49949 [2,0,0,0,0,0|2,0,0]=4 75 B7R1.2 CC1=CN=C(N)S1 SC-06546 [2,0,0,0,0,0|1,1,0]=4 76 B7R1.2 CC1=CNC(C)=C1 SC-77541 [2,0,0,0,0,0|1,0,1]=4 77 B7R1.2 CC1=CNC(C)=N1 SC-75359 [2,0,0,0,0,0|1,0,0]=3 78 B7R1.2 CC1=COC(N)=N1 SC-44401 [2,0,0,0,0,0|1,0,0]=3 79 B7R1.2 CC1=CSC(Br)=N1 SC-27043 [2,0,0,0,0,0|1,1,0]=4 80 B7R1.2 CC1=CSC(C)=C1 SC-81879 [2,0,0,0,0,0|1,1,0]=4 81 B7R1.2 CC1=CSC(C)=N1 SC-05201 [2,0,0,0,0,0|0,1,0]=3 82 B7R1.2 CC1=CSC(Cl)=N1 SC-48046 [2,0,0,0,0,0|1,1,0]=4 83 B7R1.2 CC1=CSC(N)=N1 SC-01453 [2,0,0,0,0,0|1,1,0]=4 84 B7R1.2 CC1=NC(Br)=CN1 SC-01497 [2,0,0,0,0,0|2,0,0]=4 85 B7R1.2 CC1=NC(Br)=CS1 SC-84151 [2,0,0,0,0,0|1,1,0]=4 86 B7R1.2 CC1=NC(N)=NO1 SC-29920 [2,0,0,0,0,0|2,0,0]=4 87 B7R1.2 CC1=NC=C(I)N1 SC-27923 [2,0,0,0,0,0|2,0,0]=4 88 B7R1.2 CC1=NN=C(Br)O1 SC-14747 [2,0,0,0,0,0|2,0,0]=4 89 B7R1.2 CC1=NN=C(N)O1 SC-82667 [2,0,0,0,0,0|2,0,0]=4 90 B7R1.4 CC1=C(Br)SC=N1 SC-05635 [2,0,0,0,0,0|1,1,0]=4 91 B7R1.4 CC1=C(C)NC=N1 SC-82371 [2,0,0,0,0,0|1,0,0]=3 92 B7R1.4 CC1=C(C)NC=N1 SC-97464 [2,0,0,0,0,0|1,0,0]=3 93 B7R1.4 CC1=C(N)N=CN1 SC-49171 [2,0,0,0,0,0|2,0,0]=4 94 B7R1.4 CC1=CNN=C1C SC-68905 [2,0,0,0,0,0|2,0,0]=4 95 B7R1.4 CC1=NC=CN1C SC-79883 [2,0,0,0,0,0|2,0,0]=4 96 B9R1.7 CCOC1=NC=C(Br)S1 SC-A2524 [1,1,0,0,0,0|1,1,0]=4 97 B9R1.21 OCC1=CC=C(CO)O1 SC-43665 [1,1,0,0,0,0|2,0,0]=4 98 B9R1.22 CCN1N=C(C)C=C1N SC-22171 [1,1,0,0,0,0|2,0,0]=4 99 B9R1.37 CC1=NN(C)C(C)=C1Br SC-28049 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.9 CCC1=CC(Br)=CC(CC)=N1 SC-A2717 [0,1,0,0,0,1|2,0,0]=4 101 B9R1.69 CC1=CN=C(C)C(C)=C1 SC-17578 [0,0,1,1,0,0|1,0,1]=4 102 B9R1.69 CC1=CN=C(C)C(C)=N1 SC-57940 [0,0,1,1,0,0|1,0,1]=4 103 B9R1.1 CC1=CC=C(CO)C=N1 SC-60317 [1,0,0,0,0,1|2,0,0]=4 104 B9R1.1 CC1=CN=C(CCl)C=N1 SC-65820 [1,0,0,0,0,1|2,0,0]=4 105 B9R1.1 CC1=CN=C(CCl)C=N1 SC-85570 [1,0,0,0,0,1|2,0,0]=4 106 B9R1.1 CC1=CN=C(CN)C=C1 SC-21150 [1,0,0,0,0,1|2,0,0]=4 107 B9R1.1 CC1=CN=C(CN)C=N1 SC-48361 [1,0,0,0,0,1|2,0,0]=4 108 B9R1.1 CC1=CN=C(CN)C=N1 SC-A4068 [1,0,0,0,0,1|2,0,0]=4 109 B9R1.1 CC1=CN=C(CO)C=C1 SC-13228 [1,0,0,0,0,1|2,0,0]=4 110 B9R1.1 CC1=NC=C(CCl)C=C1 SC-45714 [1,0,0,0,0,1|2,0,0]=4 111 B9R1.1 CC1=NC=C(CCl)C=C1 SC-69958 [1,0,0,0,0,1|2,0,0]=4 112 B9R1.1 CC1=NC=C(CN)C=C1 SC-12890 [1,0,0,0,0,1|2,0,0]=4 113 B9R1.1 CCC1=CN=C(N)C=C1 SC-26266 [1,0,0,0,0,1|2,0,0]=4 114 B9R1.1 COC1=CN=C(C)C=C1 SC-99858 [1,0,0,0,0,1|2,0,0]=4 115 B9R1.1 COC1=NC=C(C)C=C1 SC-47487 [1,0,0,0,0,1|2,0,0]=4 116 B9R1.34 CC1=CC(=O)C=C(C)O1 SC-48098 [1,0,0,0,0,1|2,0,0]=4 117 B9R1.34 CC1=CC(Br)=CC(C)=N1 SC-20049 [1,0,0,0,0,1|2,0,0]=4 118 B9R1.34 CC1=CC(Br)=NC(C)=C1 SC-04801 [1,0,0,0,0,1|2,0,0]=4 119 B9R1.34 CC1=CC(C)=NC(C)=C1 SC-25605 [1,0,0,0,0,1|1,0,0]=3 120 B9R1.34 CC1=CC(C)=NC(Cl)=N1 SC-04583 [1,0,0,0,0,1|2,0,0]=4 121 B9R1.34 CC1=CC(C)=NC(O)=N1 SC-77134 [1,0,0,0,0,1|2,0,0]=4 122 B9R1.34 CC1=CC(Cl)=NC(C)=C1 SC-03310 [1,0,0,0,0,1|2,0,0]=4 123 B9R1.34 CC1=CC(I)=CC(C)=N1 SC-24095 [1,0,0,0,0,1|2,0,0]=4 124 B9R1.34 CC1=CC(N)=CC(C)=N1 SC-53081 [1,0,0,0,0,1|2,0,0]=4 125 B9R1.34 CC1=CC(N)=NC(C)=C1 SC-19472 [1,0,0,0,0,1|2,0,0]=4 126 B9R1.34 CC1=CC(O)=CC(C)=N1 SC-00917 [1,0,0,0,0,1|2,0,0]=4 127 B9R1.34 CC1=NC(C)=NC(O)=C1 SC-45941 [1,0,0,0,0,1|2,0,0]=4