0 B9R1.69 CC1=C(Cl)C=CC(Cl)=N1 PKCBB_02630 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.25 CC1=CC(C)=C(CN)C=C1 PKCBB_01063 [0,1,0,0,0,0|1,0,0]=2 2 B10R1.25 CC1=CC(C)=C(CN)C=N1 PKCBB_00256 [0,1,0,0,0,0|2,0,0]=3 3 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 PKCBB_00850 [0,1,0,0,0,0|2,0,0]=3 4 B10R1.30 CC1=CC(CN)=C(C)C=C1 PKCBB_00984 [0,1,0,0,0,0|1,0,0]=2 5 B10R1.30 CNC1=C(Cl)C=CC(Cl)=C1 PKCBB_01334 [0,1,0,0,0,0|2,0,0]=3 6 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 PKCBB_00853 [0,1,0,0,0,0|2,0,0]=3 7 B10R1.119 CC1=C(C)C(=O)C=CC1=O ASIS-0226 [0,1,0,0,0,0|1,0,1]=3 8 B10R1.176 CC1=C(C)C=C(CN)C=C1 PKCBB_01085 [0,1,0,0,0,0|1,0,0]=2 9 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 PKCBB_00898 [0,1,0,0,0,0|3,0,0]=4 10 B9R1.1 CC1=CC=C(CN)C=C1 PKCBB_00974 [1,1,0,0,0,0|1,0,0]=3 11 B9R1.1 CNC1=CC=C(Cl)N=C1 PKCBB_01210 [1,1,0,0,0,0|2,0,0]=4 12 B9R1.1 NCC1=CC=C(Br)C=C1 PKCBB_02242 [1,1,0,0,0,0|1,0,0]=3 13 B9R1.1 NCC1=CC=C(Cl)C=C1 PKCBB_00840 [1,1,0,0,0,0|1,0,0]=3 14 B9R1.1 NCC1=CC=C(F)C=C1 PKCBB_00912 [1,1,0,0,0,0|1,0,0]=3 15 B9R1.2 CC1=CC=CC(CN)=C1 PKCBB_00965 [1,1,0,0,0,0|1,0,0]=3 16 B9R1.2 CNC1=CC(Cl)=NC=C1 PKCBB_01238 [1,1,0,0,0,0|2,0,0]=4 17 B9R1.2 NCC1=CC(Cl)=CC=C1 PKCBB_00891 [1,1,0,0,0,0|1,0,0]=3 18 B9R1.2 SCC1=CC(Cl)=NC=C1 PKCBB_01222 [1,1,0,0,0,0|2,0,0]=4 19 B9R1.15 CC1=C(CN)C=CC=C1 PKCBB_01013 [1,1,0,0,0,0|0,0,0]=2 20 B9R1.15 CNC1=CC=CN=C1Cl PKCBB_01233 [1,1,0,0,0,0|2,0,0]=4 21 B9R1.15 NCC1=C(Br)C=CC=C1 PKCBB_02241 [1,1,0,0,0,0|1,0,0]=3 22 B9R1.15 NCC1=C(Cl)C=CC=C1 PKCBB_00890 [1,1,0,0,0,0|1,0,0]=3 23 B9R1.15 NCC1=C(F)C=CC=C1 PKCBB_00948 [1,1,0,0,0,0|1,0,0]=3 24 B9R1.15 NCC1=CC=CN=C1Cl PKCBB_01263 [1,1,0,0,0,0|2,0,0]=4 25 B9R1.15 OCC1=CC=CN=C1Cl PKCBB_00323 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.15 SCC1=CC=CN=C1Cl PKCBB_01215 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.81 CC1=CC(C)=C(CCN)C=C1 PKCBB_01068 [0,2,0,0,0,0|1,0,0]=3 28 B11R1.81 NCCC1=C(Cl)C=C(Cl)C=C1 PKCBB_00859 [0,2,0,0,0,0|2,0,0]=4 29 B11R1.166 CC(N)C1=C(Cl)C=C(Cl)C=C1 PKCBB_00851 [0,2,0,0,0,0|2,0,0]=4 30 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 PKCBB_01064 [0,2,0,0,0,0|1,0,0]=3 31 B11R1.278 CC1=CC=C(C#N)C(=O)N1C PKCBB_01748 [0,2,0,0,0,0|2,0,0]=4 32 B11R1.167 CC(N)C1=C(Cl)C=CC(Cl)=C1 PKCBB_00860 [0,2,0,0,0,0|2,0,0]=4 33 B11R1.167 CC1=CC(C(C)N)=C(C)C=C1 PKCBB_00992 [0,2,0,0,0,0|1,0,0]=3 34 B11R1.182 CC1=CC(CCN)=C(C)C=C1 PKCBB_00979 [0,2,0,0,0,0|1,0,0]=3 35 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 PKCBB_00858 [0,2,0,0,0,0|2,0,0]=4 36 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 PKCBB_01075 [0,2,0,0,0,0|1,0,0]=3 37 B11R1.192 CC1=C(C)C=C(CCN)C=C1 PKCBB_01071 [0,2,0,0,0,0|1,0,0]=3