0 B10R1.11 CCOC(=O)C1=CC=CN1 CS10538 [1,0,0,0,0,0|2,0,1]=4 1 B10R1.11 CCOC(=O)C1=CC=CO1 MC10319 [1,0,0,0,0,0|1,0,1]=3 2 B10R1.11 CCOC(=O)C1=CC=CS1 CS14077 [1,0,0,0,0,0|1,1,1]=4 3 B10R1.11 CCOC(=O)C1=CN=CO1 CS17742 [1,0,0,0,0,0|2,0,1]=4 4 B10R1.66 O=C(O)CCC1=CC=CN1 CS21786 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.66 O=C(O)CCC1=CC=CO1 MC41688 [1,0,0,0,0,0|1,0,1]=3 6 B10R1.66 O=C(O)\C=C\C1=CC=CO1 MC41690 [1,0,0,0,0,0|1,0,1]=3 7 B12R2.246 CC1=CC2=C(OC=C2)C(Br)=C1 MC441295 [0,0,0,1,0,0|2,0,1]=4 8 B12R2.246 CC1=NC2=C(OC=C2)C(Cl)=N1 MC111159 [0,0,0,1,0,0|3,0,0]=4 9 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 CS20784 [0,0,0,0,0,1|1,0,0]=2 10 B12R1.107 O=C([O-])CC(=O)C1=CC=CC=C1 CS17400 [0,0,0,0,0,1|2,0,0]=3 11 B9R0.23 COC(=O)C(=O)CC(C)=O MC446700 [1,0,1,0,0,0|1,0,1]=4 12 B9R1.11 COC(=O)C1=CC=CN1 CS17868 [2,0,0,0,0,0|2,0,0]=4 13 B9R1.11 COC(=O)C1=CC=CO1 CS11606 [2,0,0,0,0,0|1,0,0]=3 14 B9R1.12 O=C\C=C\C1=CC=CO1 CS21800 [2,0,0,0,0,0|0,0,1]=3 15 B9R1.12 O=C\C=C\C1=CC=CO1 CS21801 [2,0,0,0,0,0|0,0,1]=3 16 B11R1.35 NC(CC1=CC=CO1)C(=O)O CS13507 [1,1,0,0,0,0|1,0,1]=4 17 B13R1.11 COC(=O)CC(=O)C1=NC=CC=C1 CS14849 [0,1,0,0,0,1|1,0,0]=3 18 B13R1.132 NC(=O)CC(=O)C1=CC=C(F)C=C1 MC427047 [0,1,0,0,0,1|2,0,0]=4 19 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O CS15783 [0,0,1,1,0,0|1,0,1]=4 20 B11R1.156 CC(=O)C1=C(F)C=CC=C1O CS19423 [0,0,1,1,0,0|1,0,1]=4 21 B11R1.156 CC(=O)C1=C(O)C=CC=C1O CS21180 [0,0,1,1,0,0|0,0,2]=4 22 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 CS22187 [0,0,1,1,0,0|2,0,0]=4 23 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 CS20944 [0,0,1,1,0,0|2,0,0]=4 24 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 MC10294 [0,0,1,1,0,0|2,0,0]=4 25 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 MC10318 [0,0,1,1,0,0|2,0,0]=4 26 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 CS21203 [0,0,1,1,0,0|2,0,0]=4 27 B11R1.86 CC(=O)NC1=NC=CC=C1O MC427313 [0,0,1,1,0,0|2,0,0]=4 28 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 CS20941 [0,0,1,1,0,0|2,0,0]=4 29 B11R1.159 CC(=O)C1=C(F)C(O)=CC=C1 MC442382 [0,0,1,1,0,0|1,0,1]=4 30 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 CS20991 [0,0,1,1,0,0|1,0,1]=4 31 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 CS20939 [0,0,1,1,0,0|0,0,2]=4 32 B11R2.106 O=C1NC=NC2=C1OC=C2 MC115902 [1,0,0,1,0,0|2,0,0]=4 33 B11R2.202 O=C1OC(=O)C2=C1C=CS2 MC114076 [1,0,0,1,0,0|1,1,0]=4 34 B11R2.36 CC1=CC2=C(C=C1)OC=C2 MC441161 [1,0,0,1,0,0|1,0,1]=4 35 B13R2.328 O=C1CC2=CC=CC=C2C(=O)N1 MC33305 [0,0,0,1,0,1|2,0,0]=4 36 B9R1.13 CC(N)CC1=CC=CO1 MC431346 [1,0,0,0,1,0|1,0,1]=4 37 B9R1.13 O=C(O)CC1=CC=CS1 CS23025 [1,0,0,0,1,0|1,1,0]=4 38 B11R1.16 CCCC(=O)C1=CC=CN=C1 MC443690 [1,0,0,0,0,1|1,0,1]=4 39 B11R1.91 CC(=O)COC1=CC=CC=C1 MC433248 [1,0,0,0,0,1|2,0,0]=4 40 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 CS22116 [0,0,0,0,0,2|2,0,0]=4 41 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 MC439497 [0,0,0,0,0,2|2,0,0]=4 42 B13R1.45 O=C(O)CNC(=O)c1ccccc1 MC34005 [0,0,0,0,0,2|2,0,0]=4