0 B10R1.13 CC1=CC=C(B(O)O)C=N1 BA1645-1 [0,1,0,0,0,0|2,0,1]=4 1 B10R1.13 NC1=CC=C(B(O)O)C=N1 BA367-1 [0,1,0,0,0,0|2,0,1]=4 2 B10R1.13 OB(O)C1=CC=C(O)N=C1 BA422-1 [0,1,0,0,0,0|2,0,1]=4 3 B10R1.61 CC1=C(B(O)O)C=CC=N1 BA327-1 [0,1,0,0,0,0|2,0,1]=4 4 B10R1.61 NC1=C(B(O)O)C=NC=C1 BA584-1 [0,1,0,0,0,0|2,0,1]=4 5 B10R1.61 NC1=NC=CC=C1B(O)O BA538-1 [0,1,0,0,0,0|2,0,1]=4 6 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 BA596-1 [0,1,0,0,0,0|2,0,1]=4 7 B10R1.61 OB(O)C1=C(F)N=CC=C1 BA322-1 [0,1,0,0,0,0|2,0,1]=4 8 B10R1.61 OB(O)C1=C(O)N=CC=C1 BA560-1 [0,1,0,0,0,0|2,0,1]=4 9 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 HB040-1 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.113 NC1=CC(B(O)O)=CN=C1 BA352-1 [0,1,0,0,0,0|2,0,1]=4 11 B10R1.113 O=C(O)C1=NC(I)=CC=C1 HB069-1 [0,1,0,0,0,0|3,0,0]=4 12 B9R1.2 COC1=CN=CC(Cl)=C1 HB131-1 [1,1,0,0,0,0|2,0,0]=4 13 B9R1.2 COC1=CN=CC(I)=C1 HB113-1 [1,1,0,0,0,0|2,0,0]=4 14 B9R1.2 COC1=CN=CC(O)=C1 HB125-1 [1,1,0,0,0,0|2,0,0]=4 15 B9R1.2 ClCC1=CC(I)=CN=C1 HB116-1 [1,1,0,0,0,0|1,0,1]=4 16 B9R1.2 O=CC1=CC(Cl)=CN=C1 HB111-1 [1,1,0,0,0,0|0,0,0]=2 17 B9R1.2 O=CC1=CC(I)=CN=C1 HB110-1 [1,1,0,0,0,0|0,0,0]=2 18 B9R1.2 OCC1=CC(I)=CN=C1 HB115-1 [1,1,0,0,0,0|0,0,2]=4 19 B9R1.15 CC1=NC=CC=C1CCl HB006-1 [1,1,0,0,0,0|1,0,1]=4 20 B9R1.15 N#CC1=CC=CN=C1N HB008-1 [1,1,0,0,0,0|0,0,2]=4 21 B9R1.15 NC1=CN=CC=C1C=O HB087-1 [1,1,0,0,0,0|2,0,0]=4 22 B11R1.36 O=C(O)[C@@H](Br)C1=CC=CC=C1 RC449-1 [0,1,0,0,0,1|2,0,0]=4 23 B11R1.36 O=C(O)[C@@H](Cl)C1=CC=CC=C1 RC484-1 [0,1,0,0,0,1|2,0,0]=4 24 B11R1.86 CC(=O)NC1=C(O)C=CN=C1 HB095-1 [0,1,0,0,0,1|1,0,0]=3 25 B11R1.86 CC(=O)NC1=CC=CN=C1O HB023-1 [0,1,0,0,0,1|1,0,0]=3 26 B11R1.21 O=[N+]([O-])C1=CN=C(Br)C(I)=C1 HB390-1 [0,2,0,0,0,0|2,0,0]=4 27 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(I)=C1 HB389-1 [0,2,0,0,0,0|2,0,0]=4 28 B11R1.166 NC(=O)C1=NC=C(Br)C=C1N HB300-1 [0,2,0,0,0,0|2,0,0]=4 29 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl HB572-1 [0,2,0,0,0,0|1,0,0]=3 30 B11R1.23 NNC(=O)C1=NC(I)=CC=C1 HB076-1 [0,2,0,0,0,0|2,0,0]=4 31 B11R1.23 NNC(=O)C1=NC=CC(Cl)=C1 HB044-1 [0,2,0,0,0,0|2,0,0]=4 32 B11R1.53 CNC1=NC=CC=C1[N+](=O)[O-] HB013-1 [0,2,0,0,0,0|2,0,0]=4 33 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] HB015-1 [0,2,0,0,0,0|2,0,0]=4 34 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=CN=C1 HB646-1 [0,2,0,0,0,0|2,0,0]=4 35 B11R1.159 O=[N+]([O-])C1=C(O)C(I)=CN=C1 HB645-1 [0,2,0,0,0,0|2,0,0]=4 36 B11R1.167 CC(=O)C1=CC(Br)=CN=C1Cl HB508-1 [0,2,0,0,0,0|1,0,0]=3 37 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl HB476-1 [0,2,0,0,0,0|1,0,0]=3 38 B11R1.167 CC(=O)C1=CC(F)=CN=C1Cl HB500-1 [0,2,0,0,0,0|1,0,0]=3 39 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 HB478-1 [0,2,0,0,0,0|1,0,0]=3 40 B11R1.167 CC1=CN=C(N)C(C(=O)O)=C1 HB477-1 [0,2,0,0,0,0|1,0,0]=3 41 B11R1.167 NC1=NC=C(F)C=C1C(=O)O HB293-1 [0,2,0,0,0,0|1,0,0]=3 42 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Cl HB333-1 [0,2,0,0,0,0|1,0,0]=3 43 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl HB369-1 [0,2,0,0,0,0|1,0,0]=3 44 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1O HB459-1 [0,2,0,0,0,0|2,0,0]=4 45 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1Br HB388-1 [0,2,0,0,0,0|2,0,0]=4 46 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1O HB386-1 [0,2,0,0,0,0|2,0,0]=4 47 B11R1.167 O=[N+]([O-])C1=CC(I)=CN=C1Br HB387-1 [0,2,0,0,0,0|2,0,0]=4 48 B11R1.167 O=[N+]([O-])C1=CC(I)=CN=C1O HB385-1 [0,2,0,0,0,0|2,0,0]=4 49 B11R1.266 COC1=CC(C(N)=O)=NC=C1 HB041-1 [0,2,0,0,0,0|2,0,0]=4 50 B11R1.266 COC1=CC=CC(C(N)=O)=N1 HB080-1 [0,2,0,0,0,0|2,0,0]=4 51 B11R1.266 COC1=CN=CC(C(C)=O)=C1 HB135-1 [0,2,0,0,0,0|1,0,0]=3 52 B11R2.1 IC1=CNC2=NC=CC=C12 HC044-1 [0,1,0,1,0,0|1,0,0]=3 53 B11R2.1 IC1=CNC2=NC=NC=C12 HC595-1 [0,1,0,1,0,0|2,0,0]=4