0 B9R1.8 CCOC1=CC=CC=N1 AC-907/25014179 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.8 ClCSC1=NC=CC=N1 AF-399/25108085 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.8 N#CSC1=CN=CC=N1 AC-907/34115041 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.8 O\N=C\C1=NC=CC=C1 AQ-405/40177765 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.2 COC1=NC=CC=N1 AC-907/25004440 [1,0,0,0,0,0|3,0,0]=4 5 B8R1.2 COC1=NN=CC=N1 AE-842/32231045 [1,0,0,0,0,0|2,0,0]=3 6 B8R1.2 CSC1=NN=CC=N1 AC-907/34115025 [1,0,0,0,0,0|2,0,0]=3 7 B8R1.2 N#CC1=CN=CC=C1 AC-907/25014098 [1,0,0,0,0,0|2,0,1]=4 8 B8R1.2 OCC1=CC=CC=N1 AE-641/00340018 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.1 CC1=CC=C(CCN)C=C1 AE-562/42006047 [0,1,0,0,0,0|3,0,0]=4 10 B10R1.1 CCOC1=CC=C(Br)C=N1 AC-907/25004667 [0,1,0,0,0,0|2,0,0]=3 11 B10R1.4 CCOC1=C(Br)C=CC=N1 AC-907/25004665 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.4 CCOC1=C(N)N=CC=C1 AF-807/00322014 [0,1,0,0,0,0|2,0,0]=3 13 B10R1.4 CCOC1=NC=CC=C1Cl AN-584/42206191 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.10 CCOC1=CC(Br)=CN=C1 AC-907/25004452 [0,1,0,0,0,0|2,0,0]=3 15 B10R1.10 CCOC1=CC(N)=CC=N1 AC-907/34119014 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.10 CCOC1=CC=NC(C)=N1 AC-907/34119015 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.10 CCOC1=CC=NC(O)=N1 AC-907/25004575 [0,1,0,0,0,0|3,0,0]=4 18 B10R1.10 CCOC1=CC=NC([O-])=N1 AC-907/25004576 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.10 CCOC1=CN=CC(O)=C1 AE-842/00015017 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.10 CCOC1=NC(Br)=CC=C1 AC-907/25005382 [0,1,0,0,0,0|2,0,0]=3 21 B10R1.10 CCSC1=NC=CC(N)=N1 AB-323/25048159 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.10 CCSC1=NC=CC(O)=N1 AB-323/25048189 [0,1,0,0,0,0|3,0,0]=4 23 B10R1.15 COC(=O)C1=CN=CC=C1 AC-907/25014170 [0,1,0,0,0,0|2,0,1]=4 24 B10R1.15 COC(=O)C1=CN=CC=N1 AN-652/40184635 [0,1,0,0,0,0|1,0,1]=3 25 B10R1.15 O=C(CBr)C1=CC=CC=N1 AM-866/25016009 [0,1,0,0,0,0|2,0,1]=4 26 B10R1.17 OCCNC1=CC=CC=N1 AE-641/00646003 [0,1,0,0,0,0|2,0,0]=3 27 B10R1.18 CC(=O)NC1=CC=CC=N1 AH-283/32233018 [0,1,0,0,0,0|2,0,1]=4 28 B10R1.18 CC(=O)NC1=CN=CC=C1 AC-907/25004679 [0,1,0,0,0,0|2,0,1]=4 29 B10R1.18 CC(=O)NC1=CN=CC=N1 AC-907/25004560 [0,1,0,0,0,0|1,0,1]=3 30 B10R1.18 CC(C)CC1=CC=NC=C1 AO-801/41077396 [0,1,0,0,0,0|3,0,0]=4 31 B10R2.7 C1=CC2=C(C=C1)NCC2 AG-690/11351758 [0,0,0,1,0,0|3,0,0]=4 32 B8R1.8 OCCC1=NC=CN1 AR-527/43293965 [0,0,0,0,1,0|1,0,1]=3 33 B7R1.3 IC1=CN=CC=C1 AC-907/30003005 [2,0,0,0,0,0|2,0,0]=4 34 B7R1.3 NC1=CC=CC=N1 AC-907/25014346 [2,0,0,0,0,0|2,0,0]=4 35 B7R1.3 NC1=CN=CC=C1 AC-907/25014070 [2,0,0,0,0,0|2,0,0]=4 36 B7R1.3 NC1=CN=CC=N1 AC-907/25014024 [2,0,0,0,0,0|1,0,0]=3 37 B7R1.3 NC1=NN=CC=N1 AO-040/25080001 [2,0,0,0,0,0|2,0,0]=4 38 B7R1.3 OC1=CC=CC=N1 AC-907/25014059 [2,0,0,0,0,0|2,0,0]=4 39 B7R1.3 OC1=CN=CC=C1 AC-907/25014060 [2,0,0,0,0,0|2,0,0]=4 40 B7R1.3 OC1=CN=CC=N1 AC-907/25004286 [2,0,0,0,0,0|1,0,0]=3 41 B7R1.3 [O-]C1=CN=CC=N1 AC-907/25004285 [2,0,0,0,0,0|1,0,0]=3 42 B9R1.1 CCC1=CC=C(C)N=C1 AC-907/25014214 [1,1,0,0,0,0|1,0,0]=3 43 B9R1.1 CCC1=NN=C(N)N=N1 AC-907/25004306 [1,1,0,0,0,0|2,0,0]=4 44 B9R1.1 COC1=CC=C(Br)C=N1 AC-907/25004518 [1,1,0,0,0,0|2,0,0]=4 45 B9R1.1 COC1=CC=C(N)C=N1 AO-080/40859930 [1,1,0,0,0,0|2,0,0]=4 46 B9R1.1 ClCC1=CN=C(Cl)C=C1 AN-717/25052001 [1,1,0,0,0,0|2,0,0]=4 47 B9R1.2 CNC1=CC=CC(Cl)=N1 AC-907/25004545 [1,1,0,0,0,0|2,0,0]=4 48 B9R1.2 CNC1=NC(Br)=CC=C1 AN-584/43416474 [1,1,0,0,0,0|2,0,0]=4 49 B9R1.2 COC1=CC(Br)=CN=C1 AC-907/25004516 [1,1,0,0,0,0|2,0,0]=4 50 B9R1.2 COC1=CC(Cl)=CN=C1 AN-584/42206185 [1,1,0,0,0,0|2,0,0]=4 51 B9R1.2 CSC1=NN=CC(N)=N1 AC-907/25004304 [1,1,0,0,0,0|2,0,0]=4 52 B9R1.6 CC(=O)C1=CN=CC=C1 AE-641/00369001 [1,1,0,0,0,0|1,0,1]=4 53 B9R1.6 CN(C)C1=CN=CC=C1 AF-807/00322051 [1,1,0,0,0,0|2,0,0]=4 54 B9R1.6 NC(=O)C1=NC=CN=C1 AC-907/25014068 [1,1,0,0,0,0|1,0,1]=4 55 B9R1.6 O=C(O)C1=CN=CC=N1 AB-131/40186434 [1,1,0,0,0,0|1,0,1]=4 56 B9R1.15 CCC1=C(C)C=CN=C1 AO-801/41077436 [1,1,0,0,0,0|1,0,0]=3 57 B9R1.15 CNC1=C(Cl)N=CC=C1 AC-907/34117030 [1,1,0,0,0,0|2,0,0]=4 58 B9R1.15 OCC1=C(O)C=CC=N1 AJ-333/25006072 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.7 CCOC1=CC(C)=NN1 AG-690/33377041 [0,1,0,0,1,0|2,0,0]=4 60 B9R1.12 N#CCCN1C=CN=C1 AF-399/25108055 [0,1,0,0,1,0|1,0,1]=4 61 B9R1.12 NCCCN1C=CC=N1 AN-919/40777063 [0,1,0,0,1,0|1,0,0]=3 62 B9R1.33 CC1=NC=CN1CCO AG-777/43491538 [0,1,0,0,1,0|2,0,0]=4 63 B9R1.33 CSCC1=C(C)NC=N1 AL-398/25017025 [0,1,0,0,1,0|1,0,1]=4 64 B11R1.81 CCOC1=CC=C(C)N=C1Br AN-584/43303034 [0,2,0,0,0,0|2,0,0]=4 65 B11R1.192 CCOC1=CC(Br)=C(Br)N=C1 AC-907/25004641 [0,2,0,0,0,0|2,0,0]=4 66 B11R1.192 CCOC1=CC(Cl)=C(Cl)C=N1 AC-907/25004652 [0,2,0,0,0,0|2,0,0]=4 67 B11R1.192 CCOC1=NC(Br)=C(Br)C=C1 AC-907/25004643 [0,2,0,0,0,0|2,0,0]=4 68 B11R1.192 CCOC1=NC(Br)=C(N)C=C1 AC-907/25004693 [0,2,0,0,0,0|2,0,0]=4 69 B11R1.182 CCOC1=C(Br)N=CC(Br)=C1 AC-907/25004644 [0,2,0,0,0,0|2,0,0]=4 70 B11R1.222 COC(=O)C1=C(N)N=CC=N1 AB-323/25048520 [0,2,0,0,0,0|1,0,1]=4 71 B11R1.24 CCCOC1=NC(N)=CC=C1 AC-907/34120018 [0,2,0,0,0,0|1,0,0]=3 72 B11R1.157 CC(C)SC1=NN=CC(N)=N1 AO-040/25080002 [0,2,0,0,0,0|2,0,0]=4 73 B11R1.12 CCB(CC)C1=NC=CC=C1 AO-289/25117006 [0,2,0,0,0,0|2,0,0]=4 74 B11R1.509 CC(C)(C)OC1=CN=CC=C1 AC-907/25004950 [0,2,0,0,0,0|2,0,0]=4 75 B11R2.106 NC1=C2CCCC2=CC=C1 AE-646/31213054 [0,1,0,1,0,0|2,0,0]=4 76 B11R2.40 NC1(C2=CC=CC=C2)CC1 AR-527/42979546 [0,1,0,1,0,0|2,0,0]=4 77 B7R1.1 CNC1=NC=CS1 AN-584/41682965 [1,0,0,0,1,0|2,0,0]=4 78 B7R1.1 OCC1=CN=CN1 AB-131/25126047 [1,0,0,0,1,0|1,0,1]=4 79 B7R1.1 OCC1=COC=C1 AE-641/00180028 [1,0,0,0,1,0|2,0,0]=4 80 B7R1.1 OCC1=NC=CN1 AR-527/43293956 [1,0,0,0,1,0|1,0,1]=4