0 B10R1.61 CC(N)C1=C(Br)C=CC=C1 PKCBB_02240 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 PKCBB_00892 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.61 CC(N)C1=C(F)C=CC=C1 PKCBB_00947 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.61 CC(N)C1=CC=CC=C1O PKCBB_00434 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.61 CC1=C(C(C)N)C=CC=C1 PKCBB_01012 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.61 NC(=S)C1=CC=CN=C1Cl PKCBB_00542 [0,0,0,0,0,0|3,1,0]=4 6 B9R1.6 CC(N)C1=CC=CC=C1 PKCBB_01014 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.15 CC1=C(CN)C=CC=C1 PKCBB_01013 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.15 NCC1=C(Br)C=CC=C1 PKCBB_02241 [1,0,0,0,0,0|2,0,1]=4 9 B9R1.15 NCC1=C(Cl)C=CC=C1 PKCBB_00890 [1,0,0,0,0,0|2,0,1]=4 10 B9R1.15 NCC1=C(F)C=CC=C1 PKCBB_00948 [1,0,0,0,0,0|2,0,1]=4 11 B9R1.15 OCC1=CC=CN=C1Cl PKCBB_00323 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.53 COC1=C(C(C)N)C=CC=C1 PKCBB_01048 [0,1,0,0,0,0|2,0,1]=4 13 B11R1.222 CC1=C(\C(N)=N/O)C=CC=C1 PKCBB_00010 [0,1,0,0,0,0|2,0,0]=3 14 B11R1.222 N\C(=N/O)C1=C(Br)C=CC=C1 PKCBB_01691 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.222 N\C(=N/O)C1=C(Cl)C=CC=C1 PKCBB_01698 [0,1,0,0,0,0|2,0,0]=3 16 B11R1.222 N\C(=N/O)C1=C(F)C=CC=C1 PKCBB_01694 [0,1,0,0,0,0|2,0,0]=3 17 B11R1.86 O=C(O)CC1=CC=CN=C1Cl PKCBB_01362 [0,0,0,0,0,1|2,0,0]=3 18 B8R1.2 NCC1=CC=CC=C1 PKCBB_01006 [2,0,0,0,0,0|1,0,1]=4 19 B10R1.15 N\C(=N/O)C1=NC=CC=C1 PKCBB_00530 [1,1,0,0,0,0|2,0,0]=4 20 B10R1.15 N\C(=N\O)C1=CC=CC=C1 PKCBB_00007 [1,1,0,0,0,0|1,0,0]=3 21 B10R1.15 N\C(=N\O)C1=CC=CN=C1 PKCBB_00004 [1,1,0,0,0,0|2,0,0]=4 22 B10R1.15 N\C(=N\O)C1=CC=NC=C1 PKCBB_00005 [1,1,0,0,0,0|2,0,0]=4 23 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 PKCBB_01218 [1,1,0,0,0,0|2,0,0]=4 24 B10R1.20 COC1=C(CN)C=CC=C1 PKCBB_01049 [1,1,0,0,0,0|1,0,1]=4 25 B12R1.371 COC(=O)CC1=CC=CN=C1Cl PKCBB_01217 [0,1,0,0,0,1|2,0,0]=4 26 B12R1.77 COC1=C(\C(N)=N\O)C=CC=C1 PKCBB_01699 [0,2,0,0,0,0|1,0,0]=3 27 B12R1.3441 N\C(=N/O)C1=C(F)C=CC=C1F PKCBB_01692 [0,2,0,0,0,0|2,0,0]=4 28 B12R1.3441 O=C(CBr)C1=C(Cl)C=CC=C1Cl PKCBB_01254 [0,2,0,0,0,0|2,0,0]=4 29 B12R1.440 O=CC1=CC=CC([N+](=O)[O-])=C1O ASIS-0026 [0,2,0,0,0,0|1,0,1]=4 30 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C PKCBB_01763 [0,2,0,0,0,0|1,0,1]=4 31 B12R1.1703 CC1=CC(C)=C(\C(N)=N\O)C=C1 PKCBB_01701 [0,2,0,0,0,0|2,0,0]=4 32 B12R1.1703 N\C(=N/O)C1=C(Cl)C=C(Cl)C=C1 PKCBB_01696 [0,2,0,0,0,0|2,0,0]=4 33 B12R1.354 CC1=CC(\C(N)=N\O)=C(C)C=C1 PKCBB_01702 [0,2,0,0,0,0|2,0,0]=4 34 B12R1.354 N\C(=N/O)C1=C(Cl)C=CC(Cl)=C1 PKCBB_00459 [0,2,0,0,0,0|2,0,0]=4 35 B8R1.7 CC(=O)C1=CC=CS1 PKCBB_01781 [1,0,0,0,1,0|2,0,0]=4