0 B8R1.8 C#CCN1C=CC=N1 CS-0047026 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.8 NCCC1=NNN=N1 CS-0084219 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.8 NCCN1C=CN=C1 CS-W005094 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.8 NCCN1N=CC=N1 CS-0079987 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.8 OCCC1=CC=CO1 CS-0047160 [0,0,0,0,0,0|1,1,0]=2 5 B8R1.8 OCCC1=CNN=C1 CS-W004817 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.8 OCCC1=NNC=C1 CS-0012680 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.8 OCCN1C=CN=N1 CS-0095270 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.8 OCCN1N=CC=N1 CS-0095268 [0,0,0,0,0,0|4,0,0]=4 9 B7R1.1 BrCC1=CC=NO1 CS-D0211 [1,0,0,0,0,0|2,1,0]=4 10 B7R1.1 CNC1=NNC=C1 CS-0047290 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.1 CNC1=NOC=C1 CS-0035514 [1,0,0,0,0,0|3,0,0]=4 12 B7R1.1 ClCC1=CSC=N1 CS-W010784 [1,0,0,0,0,0|3,0,0]=4 13 B7R1.1 N#CC1=CC=CN1 CS-D0926 [1,0,0,0,0,0|1,0,2]=4 14 B7R1.1 NCC1=CN=CO1 CS-0054595 [1,0,0,0,0,0|1,1,0]=3 15 B7R1.1 NCC1=CN=CO1 CS-W018747 [1,0,0,0,0,0|1,1,0]=3 16 B7R1.1 NCC1=CN=NN1 CS-0040886 [1,0,0,0,0,0|3,0,0]=4 17 B7R1.1 NCC1=CNN=N1 CS-B1020 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.1 NCC1=CSC=N1 CS-0038080 [1,0,0,0,0,0|2,0,0]=3 19 B7R1.1 NCC1=NN=CS1 CS-WAA0245 [1,0,0,0,0,0|2,0,0]=3 20 B7R1.1 O=CC1=CC=CN1 CS-D0925 [1,0,0,0,0,0|2,0,1]=4 21 B7R1.1 O=CC1=CN=CS1 CS-D0828 [1,0,0,0,0,0|2,0,1]=4 22 B7R1.1 OCC1=CN=CN1 CS-W013364 [1,0,0,0,0,0|3,0,0]=4 23 B7R1.1 OCC1=NC=CO1 CS-0054632 [1,0,0,0,0,0|2,1,0]=4 24 B7R1.1 OCN1C=CC=N1 CS-W019109 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.11 NCC(O)C1=CC=CO1 CS-0038432 [0,1,0,0,0,0|0,1,0]=2 26 B9R1.12 ClCCCN1C=CC=N1 CS-0036165 [0,1,0,0,0,0|3,0,0]=4 27 B9R1.33 CN1C=CN=C1CNN CS-0035680 [0,1,0,0,0,0|3,0,0]=4 28 B9R2.2 C1=NC=C(C2CC2)N1 CS-W000144 [0,0,0,1,0,0|3,0,0]=4 29 B9R2.3 C1=CC2=C(C=CS2)S1 CS-D1729 [0,0,0,1,0,0|1,0,2]=4 30 B9R2.3 C1=CC2=C(C=NN2)S1 CS-W020445 [0,0,0,1,0,0|1,0,1]=3 31 B9R2.3 C1=CN2CCCC2=N1 CS-0100195 [0,0,0,1,0,0|3,0,0]=4 32 B9R1.8 CCCC1=CC=CC=C1 CS-0035165 [0,0,0,0,0,1|2,0,0]=3 33 B9R1.8 CNCC1=NC=CC=C1 CS-0062387 [0,0,0,0,0,1|3,0,0]=4 34 B9R1.8 NNCC1=CC=CN=C1 CS-W021776 [0,0,0,0,0,1|2,0,0]=3 35 B6R1.2 CC1=CN=CS1 CS-W007489 [2,0,0,0,0,0|1,0,0]=3 36 B6R1.2 ClC1=NC=CS1 CS-D1169 [2,0,0,0,0,0|2,0,0]=4 37 B6R1.2 NC1=CC=NO1 CS-W005361 [2,0,0,0,0,0|1,1,0]=4 38 B6R1.2 NC1=CSC=C1 CS-D0258 [2,0,0,0,0,0|2,0,0]=4 39 B6R1.2 NC1=NC=NS1 CS-0037734 [2,0,0,0,0,0|2,0,0]=4 40 B6R1.2 NN1C=CC=C1 CS-W005251 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.1 CC1=CC(CN)=NO1 CS-0036286 [1,1,0,0,0,0|2,0,0]=4 42 B8R1.1 CC1=CC=C(CN)S1 CS-0036528 [1,1,0,0,0,0|0,0,0]=2 43 B8R1.1 CC1=CSC(CN)=N1 CS-B1096 [1,1,0,0,0,0|1,0,0]=3 44 B8R1.1 CCC1=CN=C(N)S1 CS-W022373 [1,1,0,0,0,0|1,0,0]=3 45 B8R1.1 CCC1=CN=C(N)S1 CS-WAA0157 [1,1,0,0,0,0|1,0,0]=3 46 B8R1.1 CCN1C=C(N)C=N1 CS-0052571 [1,1,0,0,0,0|2,0,0]=4 47 B8R1.1 N#CC1=CC(N)=CS1 CS-0103350 [1,1,0,0,0,0|0,0,2]=4 48 B8R1.1 NCC1=NC(Br)=CS1 CS-B1233 [1,1,0,0,0,0|1,0,0]=3 49 B8R1.1 OCC1=CN=C(Br)S1 CS-W008914 [1,1,0,0,0,0|2,0,0]=4 50 B8R1.1 OCC1=CN=C(Cl)S1 CS-0067979 [1,1,0,0,0,0|2,0,0]=4 51 B8R1.1 OCC1=NC(Br)=CS1 CS-B1095 [1,1,0,0,0,0|2,0,0]=4 52 B8R1.7 CC(N)C1=CN=CN1 CS-0062144 [1,1,0,0,0,0|2,0,0]=4 53 B8R1.7 CC(O)C1=CN=CN1 CS-0036021 [1,1,0,0,0,0|2,0,0]=4 54 B8R1.7 C[C@H](N)C1=CC=CS1 CS-0106541 [1,1,0,0,0,0|0,0,0]=2 55 B8R1.11 CN1N=CC=C1CN CS-0046966 [1,1,0,0,0,0|2,0,0]=4 56 B8R1.11 N#CC1=C(Br)C=CS1 CS-W019556 [1,1,0,0,0,0|0,0,2]=4 57 B8R1.11 N#CC1=C(F)C=CS1 CS-0103369 [1,1,0,0,0,0|0,0,2]=4 58 B8R1.11 NC1=C(CO)SC=C1 CS-B1079 [1,1,0,0,0,0|1,0,0]=3 59 B8R1.11 NCC1=C(Cl)C=CS1 CS-0053372 [1,1,0,0,0,0|0,0,0]=2 60 B10R1.1 NCCC1=CC=C(Br)C=C1 CS-W009109 [0,1,0,0,0,1|1,0,0]=3 61 B10R1.4 CC1=CC=CC=C1CON CS-B1209 [0,1,0,0,0,1|2,0,0]=4 62 B10R1.10 CC1=CC(CNN)=CC=C1 CS-0046882 [0,1,0,0,0,1|2,0,0]=4 63 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 CS-0028334 [0,1,0,0,0,1|1,0,0]=3 64 B10R1.15 OCC(O)C1=CC=CC=C1 CS-W016504 [0,1,0,0,0,1|2,0,0]=4 65 B10R1.17 FCCNC1=CC=CC=C1 CS-W023117 [0,1,0,0,0,1|2,0,0]=4 66 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 CS-M1415 [0,2,0,0,0,0|1,1,0]=4 67 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 CS-0035867 [0,2,0,0,0,0|1,0,1]=4 68 B10R1.66 O=C(O)CCC1=CC=CN1 CS-W021754 [0,2,0,0,0,0|2,0,0]=4 69 B10R1.66 O=C(O)CCC1=CC=CS1 CS-0043395 [0,2,0,0,0,0|1,0,0]=3 70 B10R1.187 NCCN1C(=O)C=CC1=O CS-0099569 [0,2,0,0,0,0|2,0,0]=4 71 B10R2.7 C1=CN=C2NCCC2=C1 CS-B0149 [0,0,0,1,0,1|1,0,0]=3 72 B10R2.320 BrC1CC2=CC=CC=C21 CS-W017070 [0,0,0,1,0,1|2,0,0]=4 73 B10R2.2 O=C1NC2=C(N1)SC=C2 CS-0095545 [0,1,0,1,0,0|1,0,1]=4 74 B10R2.14 NC1=NC=C(C2CC2)S1 CS-0054987 [0,1,0,1,0,0|2,0,0]=4 75 B10R2.14 NC1=NC=C(C2CC2)S1 CS-WAA0325 [0,1,0,1,0,0|2,0,0]=4