0 B8R1.8 CCCC1=NN=NN1 CS-0062127 [0,0,0,0,0,0|3,0,0]=3 1 B8R1.8 COCC1=CNN=C1 CS-0051143 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.8 ClCCN1C=CN=C1 CS-0099622 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.8 N#CCC1=CNC=N1 CS-0052326 [0,0,0,0,0,0|0,0,4]=4 4 B8R1.8 NCCC1=NN=CS1 CS-0052334 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.8 NCCN1C=NN=C1 CS-0112582 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.8 NOCC1=NC=NN1 CS-0079838 [0,0,0,0,0,0|2,0,1]=3 7 B8R1.8 ON=CC1=CC=CN1 CS-0036536 [0,0,0,0,0,0|3,0,1]=4 8 B7R1.1 BrCC1=COC=N1 CS-B1052 [1,0,0,0,0,0|2,0,1]=4 9 B7R1.1 BrCC1=NON=C1 CS-0078975 [1,0,0,0,0,0|2,0,1]=4 10 B7R1.1 CCC1=NC=CN1 CS-0111073 [1,0,0,0,0,0|2,0,0]=3 11 B7R1.1 CCC1=NNC=C1 CS-0111769 [1,0,0,0,0,0|2,0,1]=4 12 B7R1.1 CCN1C=NC=N1 CS-0038727 [1,0,0,0,0,0|1,0,1]=3 13 B7R1.1 COC1=CNN=C1 CS-0050823 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.1 CSC1=CN=CN1 CS-0062039 [1,0,0,0,0,0|1,0,0]=2 15 B7R1.1 CSC1=CNN=C1 CS-0038341 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.1 ClCC1=CN=CS1 CS-0038014 [1,0,0,0,0,0|2,0,0]=3 17 B7R1.1 NCC1=CC=NN1 CS-0047020 [1,0,0,0,0,0|2,0,0]=3 18 B7R1.1 NCC1=CC=NO1 CS-0085315 [1,0,0,0,0,0|2,0,0]=3 19 B7R1.1 NCC1=CN=CS1 CS-0053667 [1,0,0,0,0,0|1,0,0]=2 20 B7R1.1 NCC1=CON=C1 CS-0053671 [1,0,0,0,0,0|2,0,0]=3 21 B7R1.1 NCC1=NC=CN1 CS-0037877 [1,0,0,0,0,0|2,0,0]=3 22 B7R1.1 NCC1=NC=CS1 CS-0053668 [1,0,0,0,0,0|2,0,1]=4 23 B7R1.1 NCC1=NOC=C1 CS-0036308 [1,0,0,0,0,0|2,0,1]=4 24 B7R1.1 OCC1=COC=N1 CS-0037571 [1,0,0,0,0,0|2,0,1]=4 25 B7R1.1 OCC1=NC=CN1 CS-0036818 [1,0,0,0,0,0|3,0,0]=4 26 B7R1.1 OCC1=NC=NN1 CS-0038482 [1,0,0,0,0,0|2,0,1]=4 27 B7R1.1 OCC1=NON=C1 CS-0080392 [1,0,0,0,0,0|2,0,1]=4 28 B9R1.7 CC1=NC(CCN)=NO1 CS-0035515 [0,1,0,0,0,0|2,0,1]=4 29 B9R1.7 CC1=NN=C(CCO)O1 CS-0111685 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.7 CC1=NOC(CON)=C1 CS-0079754 [0,1,0,0,0,0|3,0,0]=4 31 B9R1.7 CCCC1=NN=C(N)O1 CS-0079003 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.7 NC1=NC(CCO)=CS1 CS-0100839 [0,1,0,0,0,0|2,0,1]=4 33 B9R1.7 NCCC1=CSC(N)=N1 CS-0100841 [0,1,0,0,0,0|1,0,1]=3 34 B9R1.7 NOCC1=CN=C(Cl)S1 CS-0079762 [0,1,0,0,0,0|2,0,0]=3 35 B9R1.7 OCCC1=CC(Br)=NO1 CS-0112262 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.11 N[C@H](CO)C1=CSC=C1 CS-0112425 [0,1,0,0,0,0|3,0,0]=4 37 B9R1.11 O=C(CBr)C1=CN=CS1 CS-0083451 [0,1,0,0,0,0|2,0,1]=4 38 B9R1.12 CNCCN1C=NC=N1 CS-0106199 [0,1,0,0,0,0|1,0,1]=3 39 B9R1.13 C[C@@H](N)CC1=CC=CS1 CS-0100790 [0,1,0,0,0,0|2,0,0]=3 40 B9R1.13 C[C@H](N)CC1=CC=CS1 CS-0100791 [0,1,0,0,0,0|2,0,0]=3 41 B9R1.13 O=C(O)CC1=CN=CS1 CS-0113128 [0,1,0,0,0,0|2,0,1]=4 42 B9R1.33 CC1=C(CCN)SC=N1 CS-0061205 [0,1,0,0,0,0|1,0,0]=2 43 B9R1.33 NCCC1=C(Br)SC=C1 CS-0106554 [0,1,0,0,0,0|2,0,0]=3 44 B9R1.33 OCCC1=C(Br)SC=C1 CS-0109873 [0,1,0,0,0,0|3,0,0]=4 45 B9R2.2 C1=CN(C2CC2)C=N1 CS-0036670 [0,0,0,1,0,0|3,0,0]=4 46 B9R2.3 C1=NC2=C(CNC2)S1 CS-0098308 [0,0,0,1,0,0|3,0,0]=4 47 B9R2.3 C1=NN2CCCC2=C1 CS-0054078 [0,0,0,1,0,0|3,0,0]=4 48 B9R1.8 CCNC1=CC=CN=C1 CS-0089664 [0,0,0,0,0,1|3,0,0]=4 49 B9R1.8 CNCC1=CC=CN=C1 CS-0020099 [0,0,0,0,0,1|3,0,0]=4 50 B9R1.8 CNCC1=CN=CN=C1 CS-0048870 [0,0,0,0,0,1|2,0,1]=4 51 B9R1.8 ClCCC1=NC=CC=C1 CS-0096286 [0,0,0,0,0,1|2,0,1]=4 52 B9R1.8 N#CCC1=CC=NC=N1 CS-0052207 [0,0,0,0,0,1|0,0,3]=4 53 B9R1.8 N#CCC1=CC=NN=C1 CS-0052210 [0,0,0,0,0,1|1,0,2]=4 54 B9R1.8 N#CCC1=CN=CN=C1 CS-0052206 [0,0,0,0,0,1|0,0,3]=4 55 B9R1.8 NCCC1=NC=NC=C1 CS-0057455 [0,0,0,0,0,1|0,0,1]=2 56 B9R1.8 NNCC1=CC=NC=C1 CS-0051151 [0,0,0,0,0,1|2,0,0]=3 57 B9R1.8 NNCC1=CN=CC=C1 CS-0051688 [0,0,0,0,0,1|2,0,0]=3 58 B9R1.8 NNCC1=NC=CC=C1 CS-0052228 [0,0,0,0,0,1|2,0,1]=4 59 B9R1.8 OCCC1=NN=CC=C1 CS-0112570 [0,0,0,0,0,1|2,0,1]=4 60 B6R1.2 CC1=CC=NO1 CS-0085310 [2,0,0,0,0,0|2,0,0]=4 61 B6R1.2 CC1=NC=CN1 CS-0111072 [2,0,0,0,0,0|2,0,0]=4 62 B6R1.2 CC1=NC=CN1 CS-0111074 [2,0,0,0,0,0|2,0,0]=4 63 B6R1.2 FC1=CN=CN1 CS-0035781 [2,0,0,0,0,0|1,0,0]=3 64 B6R1.2 NC1=CC=CN1 CS-0112997 [2,0,0,0,0,0|1,0,0]=3 65 B6R1.2 NC1=CC=NS1 CS-0062263 [2,0,0,0,0,0|2,0,0]=4 66 B6R1.2 NC1=CSC=C1 CS-0096335 [2,0,0,0,0,0|2,0,0]=4 67 B6R1.2 NC1=CSC=N1 CS-0044686 [2,0,0,0,0,0|1,0,1]=4 68 B6R1.2 NC1=CSN=C1 CS-0040497 [2,0,0,0,0,0|2,0,0]=4 69 B6R1.2 NC1=CSN=C1 CS-0049320 [2,0,0,0,0,0|2,0,0]=4 70 B6R1.2 NN1C=CN=C1 CS-0112886 [2,0,0,0,0,0|2,0,0]=4 71 B6R1.2 NN1C=NC=N1 CS-0077369 [2,0,0,0,0,0|1,0,1]=4 72 B8R1.1 CC1=CC(CN)=CS1 CS-0109604 [1,1,0,0,0,0|2,0,0]=4 73 B8R1.1 CC1=CC=C(CN)S1 CS-0035951 [1,1,0,0,0,0|2,0,0]=4 74 B8R1.1 CC1=NC=C(CCl)S1 CS-0037238 [1,1,0,0,0,0|2,0,0]=4 75 B8R1.1 CC1=NC=C(CN)S1 CS-0113081 [1,1,0,0,0,0|1,0,0]=3 76 B8R1.1 CC1=NC=C(CO)O1 CS-0061386 [1,1,0,0,0,0|2,0,0]=4 77 B8R1.1 CC1=NOC(CN)=C1 CS-0085262 [1,1,0,0,0,0|2,0,0]=4 78 B8R1.1 CN1C=C(CN)C=N1 CS-0053646 [1,1,0,0,0,0|2,0,0]=4 79 B8R1.1 CN1C=NC(CN)=C1 CS-0053655 [1,1,0,0,0,0|0,0,2]=4 80 B8R1.1 CN1C=NC(CN)=C1 CS-0053656 [1,1,0,0,0,0|0,0,2]=4 81 B8R1.1 CN1C=NC(CN)=C1 CS-0053657 [1,1,0,0,0,0|0,0,2]=4 82 B8R1.1 NC1=NC=C(CO)S1 CS-0060290 [1,1,0,0,0,0|2,0,0]=4 83 B8R1.1 NCC1=CC(Br)=CS1 CS-0041883 [1,1,0,0,0,0|2,0,0]=4 84 B8R1.1 NCC1=CC(Br)=CS1 CS-0053205 [1,1,0,0,0,0|2,0,0]=4 85 B8R1.1 NCC1=CC=C(Br)S1 CS-W000781 [1,1,0,0,0,0|2,0,0]=4 86 B8R1.1 NCC1=CC=C(Cl)S1 CS-0053153 [1,1,0,0,0,0|2,0,0]=4 87 B8R1.1 NCC1=CC=C(F)S1 CS-0053145 [1,1,0,0,0,0|2,0,0]=4 88 B8R1.1 NCC1=CN=C(Br)S1 CS-0059795 [1,1,0,0,0,0|1,0,0]=3 89 B8R1.1 NCC1=CSC(Br)=C1 CS-0053158 [1,1,0,0,0,0|2,0,0]=4 90 B8R1.1 NCC1=CSC(Cl)=C1 CS-0053151 [1,1,0,0,0,0|2,0,0]=4 91 B8R1.1 O=CC1=CN=C(Br)N1 CS-0112982 [1,1,0,0,0,0|1,0,1]=4 92 B8R1.7 CC(C)C1=CNN=C1 CS-0099865 [1,1,0,0,0,0|2,0,0]=4 93 B8R1.7 CC(N)C1=CSC=C1 CS-D0194 [1,1,0,0,0,0|2,0,0]=4 94 B8R1.7 CC(N)C1=NN=CN1 CS-0091425 [1,1,0,0,0,0|1,0,0]=3 95 B8R1.11 CCC1=C(Br)SC=C1 CS-0106558 [1,1,0,0,0,0|2,0,0]=4 96 B8R1.11 CN1C=CC=C1CN CS-W005958 [1,1,0,0,0,0|1,0,0]=3 97 B8R1.11 CN1C=NC=C1C#N CS-0052469 [1,1,0,0,0,0|0,0,2]=4 98 B8R1.11 CN1C=NC=C1CO CS-0035532 [1,1,0,0,0,0|1,0,0]=3 99 B8R1.11 CN1N=NN=C1CN CS-0108476 [1,1,0,0,0,0|2,0,0]=4 100 B10R1.1 NCCC1=CC=C(Br)C=N1 CS-0052266 [0,1,0,0,0,1|1,0,1]=4 101 B10R1.1 NNCC1=CN=C(Cl)C=C1 CS-0060453 [0,1,0,0,0,1|2,0,0]=4 102 B10R1.4 NCCC1=NC=CC=C1Br CS-0052284 [0,1,0,0,0,1|1,0,1]=4 103 B10R1.4 OCCC1=C(Br)C=NC=C1 CS-0112722 [0,1,0,0,0,1|2,0,0]=4 104 B10R1.15 NC(CO)C1=CC=NC=C1 CS-0089931 [0,1,0,0,0,1|2,0,0]=4 105 B10R1.17 CCNCC1=CC=CN=C1 CS-0088368 [0,1,0,0,0,1|2,0,0]=4 106 B10R1.17 NCCOC1=CC=NC=C1 CS-0096297 [0,1,0,0,0,1|1,0,0]=3 107 B10R1.17 NCCOC1=NC=CN=C1 CS-0096296 [0,1,0,0,0,1|0,0,1]=3 108 B10R1.27 COC(=O)CC1=CN=CN1 CS-0054332 [0,2,0,0,0,0|1,0,1]=4 109 B10R1.29 CNCCN1C=CN=C1C CS-0098940 [0,2,0,0,0,0|2,0,0]=4 110 B10R1.66 O=C(O)CCC1=CN=CN1 CS-0038274 [0,2,0,0,0,0|1,0,0]=3 111 B8R1.2 NCC1=CC=NC=N1 CS-0048728 [0,0,1,1,0,0|0,0,2]=4 112 B8R1.2 NCC1=CN=CN=C1 CS-0053092 [0,0,1,1,0,0|0,0,2]=4 113 B8R1.2 NCC1=NC=NC=C1 CS-0048729 [0,0,1,1,0,0|0,0,2]=4 114 B10R2.7 C1=CC2=C(C=N1)CCO2 CS-0091894 [0,0,0,1,0,1|2,0,0]=4 115 B10R2.14 BrC1=NC=C(C2CC2)S1 CS-0107184 [0,1,0,1,0,0|2,0,0]=4 116 B10R2.14 ClC1=NC=C(C2CC2)S1 CS-0112607 [0,1,0,1,0,0|2,0,0]=4 117 B10R2.32 OC1CCC2=C1OC=N2 CS-0094633 [0,1,0,1,0,0|2,0,0]=4 118 B10R2.32 OC1CCN2C=NC=C12 CS-0094635 [0,1,0,1,0,0|1,0,0]=3