0 B9R1.11 COC(=O)C1=CC=NS1 MC106643 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.11 COC(=O)C1=CCCC1 CS18911 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.11 COC(=O)C1=CNC=N1 CS18794 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.11 COC(=O)C1=CNN=N1 CS13476 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.11 COC(=O)C1=NC=CN1 CS15200 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.11 COC(=O)C1=NNC=C1 CS11588 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.11 COC(=O)C1=NNC=N1 CS16131 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.11 COC(=O)C1=NNN=C1 CS17729 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.11 COC(=O)C1CCCN1 CS11440 [0,0,0,0,0,0|2,0,2]=4 9 B9R1.11 COC(=O)C1CCCN1 CS18447 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.11 COC(=O)C1CCCN1 MC438131 [0,0,0,0,0,0|2,0,2]=4 11 B9R1.11 O=C(CBr)C1=NC=CS1 CS21325 [0,0,0,0,0,0|1,0,2]=3 12 B8R1.7 CC(=O)C1=CC=CS1 CS19387 [1,0,0,0,0,0|1,0,2]=4 13 B8R1.7 CC(=O)C1=CN=NS1 MC106686 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.7 CC(=O)C1=CNC=N1 CS20378 [1,0,0,0,0,0|2,0,1]=4 15 B8R1.7 CC(=O)C1=CSC=N1 CS13244 [1,0,0,0,0,0|2,0,1]=4 16 B8R1.7 CC(=O)C1=NC=CO1 CS20443 [1,0,0,0,0,0|0,1,2]=4 17 B8R1.7 CC(=O)C1=NC=CS1 CS22755 [1,0,0,0,0,0|0,0,2]=3 18 B8R1.7 CC(=O)C1=NNC=C1 CS13441 [1,0,0,0,0,0|2,0,1]=4 19 B8R1.7 CC(=O)C1=NOC=C1 MC116141 [1,0,0,0,0,0|2,0,1]=4 20 B8R1.7 CC(=O)C1CCCC1 CS20673 [1,0,0,0,0,0|2,0,1]=4 21 B8R1.7 CC(=O)C1CCCC1 MC445790 [1,0,0,0,0,0|2,0,1]=4 22 B8R1.7 O=C(O)C1=NC=CS1 MC425486 [1,0,0,0,0,0|1,0,2]=4 23 B8R1.7 O=C(O)C1NCCS1 CS16514 [1,0,0,0,0,0|1,0,2]=4 24 B10R1.11 CCNC(=O)C1CCCN1 MC438120 [0,1,0,0,0,0|1,0,2]=4 25 B10R1.11 CCNC(=O)C1CCCN1 MC438121 [0,1,0,0,0,0|1,0,2]=4 26 B10R1.11 CCOC(=O)C1=CC=CS1 CS14077 [0,1,0,0,0,0|1,0,2]=4 27 B10R1.11 CCOC(=O)C1=CN=CS1 CS11320 [0,1,0,0,0,0|2,0,1]=4 28 B10R1.11 CCOC(=O)C1=CN=NS1 MC105773 [0,1,0,0,0,0|3,0,0]=4 29 B10R1.11 CCOC(=O)C1=CNC=N1 CS18895 [0,1,0,0,0,0|2,0,1]=4 30 B10R1.11 CCOC(=O)C1=CNN=N1 CS20694 [0,1,0,0,0,0|3,0,0]=4 31 B10R1.11 CCOC(=O)C1=COC=N1 CS18179 [0,1,0,0,0,0|2,0,1]=4 32 B10R1.11 CCOC(=O)C1=NC=CN1 CS18245 [0,1,0,0,0,0|1,0,2]=4 33 B10R1.11 CCOC(=O)C1=NC=NS1 MC106084 [0,1,0,0,0,0|1,0,1]=3 34 B10R1.11 CCOC(=O)C1=NN=NN1 MC20483 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.11 CCOC(=O)C1=NNC=C1 CS20723 [0,1,0,0,0,0|2,0,1]=4 36 B10R1.14 COC(=O)C1=NC(Br)=CS1 MC121155 [0,1,0,0,0,0|1,0,2]=4 37 B10R1.14 COC(=O)C1=NC(C)=CS1 CS11649 [0,1,0,0,0,0|1,0,2]=4 38 B10R1.14 COC(=O)C1=NC(C)=NS1 MC42244 [0,1,0,0,0,0|2,0,1]=4 39 B10R1.14 COC(=O)C1=NC=C(C)S1 MC20969 [0,1,0,0,0,0|1,0,2]=4 40 B10R1.14 COC(=O)C1=NC=C(N)S1 MC104624 [0,1,0,0,0,0|1,0,2]=4 41 B10R1.23 CC(O)C(=O)N1CCCC1 MC41678 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.149 COC(=O)C1SCCC1=O CS11632 [0,1,0,0,0,0|2,0,1]=4 43 B8R0.3 CCOC(=O)C(=O)CBr CS18430 [0,0,1,0,0,0|2,1,0]=4 44 B8R0.3 CCOC(=O)C(=O)CC CS13439 [0,0,1,0,0,0|1,1,0]=3 45 B8R0.6 CCCSCC(=O)OC MC434048 [0,0,1,0,0,0|2,0,1]=4 46 B10R2.32 O=C1CCC2=C1SC=C2 MC429082 [0,0,0,1,0,0|1,0,2]=4 47 B10R2.178 O=C1CCC2CCC1N2 MC105539 [0,0,0,1,0,0|1,0,2]=4 48 B10R1.15 COC(=O)C1=CCOCC1 MC113105 [0,0,0,0,0,1|3,0,0]=4 49 B7R0.4 CCC\C=C\C(C)=O MC20875 [1,0,1,0,0,0|2,0,0]=4 50 B7R1.1 COC1=NCCC1 CS10423 [2,0,0,0,0,0|2,0,0]=4 51 B7R1.1 ClCC1=NCCN1 CS13610 [2,0,0,0,0,0|2,0,0]=4 52 B7R1.1 NNC1=NCCS1 MC117252 [2,0,0,0,0,0|2,0,0]=4 53 B7R1.1 O=CC1=CCCC1 CS12865 [2,0,0,0,0,0|2,0,0]=4 54 B9R0.6 CCOC(=O)C(=O)C(C)C MC41914 [0,1,1,0,0,0|1,1,0]=4 55 B9R0.6 CCOC(=O)C(=O)C(C)Cl MC107439 [0,1,1,0,0,0|1,1,0]=4 56 B9R0.35 CCCC(=O)C(=O)OCC CS14582 [0,1,1,0,0,0|1,1,0]=4 57 B9R0.35 CCOC(=N)C(=O)OCC CS13440 [0,1,1,0,0,0|0,1,0]=3 58 B9R0.35 CCOC(=O)C(=O)OCC MC41888 [0,1,1,0,0,0|1,1,0]=4 59 B9R1.73 CCOC(=O)C1CCC1 MC41840 [0,1,0,0,1,0|1,0,1]=4 60 B11R1.30 CCOC(=O)CC1=NC=CS1 CS13253 [0,1,0,0,0,1|0,0,2]=4 61 B11R1.15 CCOC(=O)C1=NC(C)=NS1 MC42243 [0,2,0,0,0,0|1,0,1]=4 62 B11R1.15 CCOC(=O)C1=NC=C(Br)S1 MC428242 [0,2,0,0,0,0|0,0,2]=4 63 B11R1.15 CCOC(=O)C1=NN=C(Br)S1 CS12711 [0,2,0,0,0,0|1,0,1]=4 64 B11R1.15 CCOC(=O)C1=NN=C(Cl)S1 CS11372 [0,2,0,0,0,0|1,0,1]=4 65 B11R1.15 CCOC(=O)C1=NN=C(I)S1 CS17829 [0,2,0,0,0,0|1,0,1]=4 66 B11R1.15 CCOC(=O)C1=NN=C(N)S1 CS10195 [0,2,0,0,0,0|1,0,1]=4 67 B11R2.11 SC1CN(C2=NCCS2)C1 MC113959 [0,1,0,1,0,0|2,0,0]=4 68 B7R1.22 COC(=O)C1CC1 MC41839 [0,0,0,0,2,0|1,0,1]=4 69 B7R1.22 O=C(CBr)C1CC1 MC433212 [0,0,0,0,2,0|1,0,1]=4