0 B11R1.280 CCC1=CC=C(O)C(C=O)=C1 JL-10I-001 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.30 COC1=CC(N)=CC=C1F ACI-05283 [1,0,0,0,0,0|2,0,0]=3 2 B10R1.30 N#CC1=CC(F)=CC=C1O ACI-02301 [1,0,0,0,0,0|3,0,0]=4 3 B10R1.172 C=CC1=NC=CC(OC)=C1 ACI-05094 [1,0,0,0,0,0|1,0,0]=2 4 B10R1.172 COC1=CC=NC(C#N)=C1 ACI-00467 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.172 O=CC1=CC=CC(CBr)=C1 ACI-03882 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.176 CC1=CC(NN)=CC=C1Cl FD-10E-001 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1I ACI-04693 [0,1,0,0,0,0|3,0,0]=4 8 B12R2.44 NNC1=CC2=C(C=C1)OCO2 ACI-04727 [0,0,0,1,0,0|2,0,0]=3 9 B12R2.44 O=CC1=CC=C2OC=CC2=C1 ACI-05337 [0,0,0,1,0,0|2,0,1]=4 10 B12R2.44 O=CC1=CC=C2OCCC2=C1 ACI-01523 [0,0,0,1,0,0|2,0,0]=3 11 B9R1.2 COC1=CC(Br)=CN=C1 ACI-05645 [2,0,0,0,0,0|2,0,0]=4 12 B9R1.15 CNC1=CC=CC=C1O ACI-05339 [2,0,0,0,0,0|1,0,0]=3 13 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06376 [2,0,0,0,0,0|2,0,0]=4 14 B9R1.15 COC1=C(Br)C=NC=C1 ACI-06377 [2,0,0,0,0,0|2,0,0]=4 15 B9R1.15 COC1=CC=CN=C1Br ACI-01447 [2,0,0,0,0,0|2,0,0]=4 16 B9R1.15 NCC1=CC=CC=C1O ACI-02209 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.69 CC1=CC(S)=CC=C1Br ACI-02413 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.69 NC1=C(O)C=CC(O)=C1 ACI-06428 [2,0,0,0,0,0|2,0,0]=4 19 B11R1.189 COC1=CC=CC(\C=N\O)=C1 RJC-03I-001 [1,1,0,0,0,0|1,0,0]=3 20 B11R1.266 COC1=CC(C(=N)N)=CC=C1 ACI-NI-00259 [1,1,0,0,0,0|1,0,0]=3 21 B11R1.266 COC1=CC(C(C)=O)=NC=C1 ACI-00419 [1,1,0,0,0,0|1,0,1]=4 22 B11R1.266 COC1=CC(C(N)=S)=CC=C1 ACI-NI-00260 [1,1,0,0,0,0|1,0,0]=3 23 B11R1.266 COC1=CC=NC(C(=O)O)=C1 ACI-NI-00709 [1,1,0,0,0,0|2,0,0]=4 24 B11R1.21 CC1=C(Br)C=CC(C(=N)N)=C1 ACI-03943 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.21 CC1=C(Br)C=CC(C(=O)Cl)=C1 ACI-03963 [1,1,0,0,0,0|2,0,0]=4 26 B11R1.21 CC1=C(Br)C=CC(C(N)=O)=C1 ACI-03954 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.21 CC1=C(C)C=C(C(=N)N)C=C1 ACI-03942 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.21 CC1=C(C)C=C(C(N)=O)C=C1 ACI-03953 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.21 O=C(O)C1=CC=C(O)C(I)=C1 ACI-02694 [1,1,0,0,0,0|2,0,0]=4 30 B13R1.298 COC1=CC([N+](=O)[O-])=CC(Br)=C1O ACI-04788 [0,2,0,0,0,0|2,0,0]=4 31 B13R1.651 COC1=CC(C(=O)O)=C(Br)C=C1C ACI-05599 [0,2,0,0,0,0|2,0,0]=4 32 B13R1.651 COC1=CC(C(=O)O)=C(Br)C=C1Cl ACI-05602 [0,2,0,0,0,0|2,0,0]=4 33 B13R1.651 COC1=CC(C(=O)O)=C(Br)C=C1F ACI-05600 [0,2,0,0,0,0|2,0,0]=4 34 B13R1.2431 COC(=O)C1=CC(C#N)=CC=C1O ACI-05685 [0,2,0,0,0,0|1,0,1]=4 35 B11R1.1 CC1=CC=C(\C=C\CO)C=C1 ACI-05923 [0,0,1,1,0,0|1,0,1]=4 36 B13R2.430 NC(=O)C1=CC2=C(C=C1)OCO2 ACI-05425 [0,1,0,1,0,0|1,0,0]=3 37 B13R2.430 NC(=O)C1=CC=C2OCCC2=C1 ACI-05408 [0,1,0,1,0,0|2,0,0]=4 38 B13R2.430 O=C(Cl)C1=CC2=C(C=C1)OCO2 ACI-02355 [0,1,0,1,0,0|1,0,0]=3 39 B13R2.430 O=C(Cl)C1=CC=C2OCCC2=C1 SB-05G-003 [0,1,0,1,0,0|2,0,0]=4 40 B13R2.57 N#CC1=CC=C2OCCOC2=C1 JM-11A-001 [0,1,0,1,0,0|1,0,1]=4 41 B13R2.449 O=C=NC1=CC2=C(C=C1)OCO2 SB-09E-002 [0,1,0,1,0,0|1,0,1]=4 42 B9R1.14 COC1=C(C=O)SC=C1 ACI-05570 [1,0,0,0,1,0|2,0,0]=4 43 B9R1.14 COC1=CSC=C1C=O ACI-01992 [1,0,0,0,1,0|2,0,0]=4