0 B9R1.1 CC1=CC=C(CN)C=C1 PKCBB_00974 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.1 CNC1=CC=C(Cl)N=C1 PKCBB_01210 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.1 NCC1=CC=C(Br)C=C1 PKCBB_02242 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.1 NCC1=CC=C(Cl)C=C1 PKCBB_00840 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.1 NCC1=CC=C(F)C=C1 PKCBB_00912 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.2 NCC1=CC=CC=C1 PKCBB_01006 [1,0,0,0,0,0|1,0,0]=2 6 B8R1.2 SCC1=CC=NC=C1 PKCBB_02053 [1,0,0,0,0,0|1,1,0]=3 7 B8R1.2 SCC1=NC=CC=C1 PKCBB_02004 [1,0,0,0,0,0|1,1,0]=3 8 B10R1.1 CC1=CC=C(CCN)C=C1 PKCBB_00962 [0,1,0,0,0,0|2,0,0]=3 9 B10R1.1 N#CCC1=CC=C(Br)C=C1 PKCBB_00324 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.1 NCCC1=CC=C(Br)C=C1 PKCBB_02263 [0,1,0,0,0,0|2,0,0]=3 11 B10R1.1 NCCC1=CC=C(Cl)C=C1 PKCBB_00842 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.1 NCCC1=CC=C(F)C=C1 PKCBB_00928 [0,1,0,0,0,0|2,0,0]=3 13 B10R1.3 COC1=CC=C(CN)C=C1 PKCBB_00873 [0,1,0,0,0,0|1,0,0]=2 14 B10R1.13 CC(N)C1=CC=C(Br)C=C1 PKCBB_02244 [0,1,0,0,0,0|2,0,0]=3 15 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 PKCBB_00841 [0,1,0,0,0,0|2,0,0]=3 16 B10R1.13 CC(N)C1=CC=C(F)C=C1 PKCBB_00913 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.13 CC1=CC=C(C(C)N)C=C1 PKCBB_00975 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.25 CC1=CC(C)=C(CN)C=C1 PKCBB_01063 [0,1,0,0,0,0|2,0,0]=3 19 B10R1.25 CC1=CC(C)=C(CN)C=N1 PKCBB_00256 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 PKCBB_00850 [0,1,0,0,0,0|2,0,0]=3 21 B10R1.176 CC1=C(C)C=C(CN)C=C1 PKCBB_01085 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 PKCBB_00898 [0,1,0,0,0,0|2,0,0]=3 23 B9R1.2 CC1=CC=CC(CN)=C1 PKCBB_00965 [1,1,0,0,0,0|1,0,0]=3 24 B9R1.2 NCC1=CC(Cl)=CC=C1 PKCBB_00891 [1,1,0,0,0,0|1,0,0]=3 25 B9R1.2 SCC1=CC(Cl)=NC=C1 PKCBB_01222 [1,1,0,0,0,0|1,1,0]=4 26 B9R1.6 CC(N)C1=CC=CC=C1 PKCBB_01014 [1,1,0,0,0,0|1,0,0]=3 27 B9R1.6 CC(S)C1=CC=CN=C1 PKCBB_02051 [1,1,0,0,0,0|1,1,0]=4 28 B9R1.6 CC(S)C1=CC=NC=C1 PKCBB_02056 [1,1,0,0,0,0|1,1,0]=4 29 B9R1.6 CC(S)C1=NC=CC=C1 PKCBB_02046 [1,1,0,0,0,0|1,1,0]=4 30 B9R1.8 NCCC1=CC=CC=C1 PKCBB_01021 [1,1,0,0,0,0|1,0,0]=3 31 B9R1.8 NOCC1=CC=CN=C1 PKCBB_02049 [1,1,0,0,0,0|1,0,0]=3 32 B9R1.8 NOCC1=CC=NC=C1 PKCBB_02054 [1,1,0,0,0,0|1,0,0]=3 33 B9R1.8 NOCC1=NC=CC=C1 PKCBB_02006 [1,1,0,0,0,0|1,0,0]=3 34 B9R1.15 CC1=C(CN)C=CC=C1 PKCBB_01013 [1,1,0,0,0,0|1,0,0]=3 35 B9R1.15 NCC1=C(Br)C=CC=C1 PKCBB_02241 [1,1,0,0,0,0|1,0,0]=3 36 B9R1.15 NCC1=C(Cl)C=CC=C1 PKCBB_00890 [1,1,0,0,0,0|1,0,0]=3 37 B9R1.15 NCC1=C(F)C=CC=C1 PKCBB_00948 [1,1,0,0,0,0|1,0,0]=3 38 B9R1.15 NCC1=CC=CN=C1Cl PKCBB_01263 [1,1,0,0,0,0|2,0,0]=4 39 B9R1.15 OCC1=CC=CN=C1Cl PKCBB_00323 [1,1,0,0,0,0|1,0,0]=3 40 B9R1.15 SCC1=CC=CN=C1Cl PKCBB_01215 [1,1,0,0,0,0|1,1,0]=4 41 B11R1.1 CC1=CC=C(CCCN)C=C1 PKCBB_00990 [0,2,0,0,0,0|2,0,0]=4 42 B11R1.1 CC1=CC=C(OCCN)C=C1 PKCBB_00988 [0,2,0,0,0,0|2,0,0]=4 43 B11R1.1 NCCCC1=CC=C(Br)C=C1 PKCBB_02252 [0,2,0,0,0,0|2,0,0]=4 44 B11R1.1 NCCCC1=CC=C(Cl)C=C1 PKCBB_00843 [0,2,0,0,0,0|2,0,0]=4 45 B11R1.1 NCCCC1=CC=C(F)C=C1 PKCBB_00925 [0,2,0,0,0,0|2,0,0]=4 46 B11R1.1 NCCOC1=CC=C(Br)C=C1 PKCBB_02257 [0,2,0,0,0,0|2,0,0]=4 47 B11R1.1 NCCOC1=CC=C(Cl)C=C1 PKCBB_00846 [0,2,0,0,0,0|2,0,0]=4 48 B11R1.1 NCCOC1=CC=C(F)C=C1 PKCBB_00915 [0,2,0,0,0,0|2,0,0]=4 49 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 PKCBB_02262 [0,2,0,0,0,0|2,0,0]=4 50 B11R1.22 CC(CN)C1=CC=C(Cl)C=C1 PKCBB_02544 [0,2,0,0,0,0|2,0,0]=4 51 B11R1.22 CC(CN)C1=CC=C(F)C=C1 PKCBB_00927 [0,2,0,0,0,0|2,0,0]=4 52 B11R1.22 CC1=CC=C(C(C)CN)C=C1 PKCBB_01661 [0,2,0,0,0,0|2,0,0]=4 53 B11R1.22 CC1=CC=C(\C(N)=N/O)C=C1 PKCBB_00001 [0,2,0,0,0,0|1,0,1]=4 54 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 PKCBB_02266 [0,2,0,0,0,0|2,0,0]=4 55 B11R1.22 CCC(N)C1=CC=C(C)C=C1 PKCBB_00983 [0,2,0,0,0,0|2,0,0]=4 56 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 PKCBB_00210 [0,2,0,0,0,0|2,0,0]=4 57 B11R1.22 CCC(N)C1=CC=C(F)C=C1 PKCBB_00921 [0,2,0,0,0,0|2,0,0]=4 58 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 PKCBB_01690 [0,2,0,0,0,0|1,0,1]=4 59 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 PKCBB_01693 [0,2,0,0,0,0|1,0,1]=4 60 B11R1.22 N\C(=N\O)C1=CC=C(Cl)C=C1 PKCBB_00006 [0,2,0,0,0,0|1,0,1]=4 61 B11R1.81 CC1=CC(C)=C(CCN)C=C1 PKCBB_01068 [0,2,0,0,0,0|2,0,0]=4 62 B11R1.81 NCCC1=C(Cl)C=C(Cl)C=C1 PKCBB_00859 [0,2,0,0,0,0|2,0,0]=4 63 B11R1.83 CCC1=CN=C(CON)C=C1 PKCBB_01227 [0,2,0,0,0,0|2,0,0]=4 64 B11R1.83 COC1=CC=C(CCN)C=C1 PKCBB_00877 [0,2,0,0,0,0|1,0,0]=3 65 B11R1.192 CC1=C(C)C=C(CCN)C=C1 PKCBB_01071 [0,2,0,0,0,0|2,0,0]=4 66 B11R1.192 NCCC1=CC(Cl)=C(Cl)C=C1 PKCBB_00935 [0,2,0,0,0,0|2,0,0]=4 67 B11R1.3 CCC1=CN=C(C(C)O)C=C1 PKCBB_00424 [0,2,0,0,0,0|2,0,0]=4 68 B11R1.3 COC1=CC=C(C(C)N)C=C1 PKCBB_00874 [0,2,0,0,0,0|1,0,0]=3 69 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 PKCBB_02265 [0,2,0,0,0,0|2,0,0]=4 70 B11R1.19 CC(C)(N)C1=CC=C(Cl)C=C1 PKCBB_00235 [0,2,0,0,0,0|2,0,0]=4 71 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 PKCBB_00923 [0,2,0,0,0,0|2,0,0]=4 72 B11R1.19 CC1=CC=C(C(C)(C)N)C=C1 PKCBB_01662 [0,2,0,0,0,0|2,0,0]=4 73 B11R1.21 CC(N)C1=CC(Cl)=C(Cl)C=C1 PKCBB_00932 [0,2,0,0,0,0|2,0,0]=4 74 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 PKCBB_01075 [0,2,0,0,0,0|2,0,0]=4 75 B11R1.166 CC(N)C1=C(Cl)C=C(Cl)C=C1 PKCBB_00851 [0,2,0,0,0,0|2,0,0]=4 76 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 PKCBB_01064 [0,2,0,0,0,0|2,0,0]=4 77 B11R1.280 N#CC1=C(O)C=CC(C=O)=C1 ASIS-0029 [0,2,0,0,0,0|0,0,2]=4