0 B16R1.13650 CCOC(=O)\C(=C\C1=CC=CC=C1)C(C)=O E69586 [0,0,0,0,0,0|0,0,0]=0 1 B17R2.50008 CCOC(=O)C1=CC2=C(C=CC=C2)NC1=O E1650 [0,0,0,1,0,0|1,0,0]=2 2 B17R2.50008 CCOC(=O)C1=CC2=CC=CN=C2NC1=O E12915 [0,0,0,1,0,0|2,0,0]=3 3 B17R2.50008 CCOC(=O)C1=NC2=CC=CC=C2C=C1N E55711 [0,0,0,1,0,0|2,0,1]=4 4 B17R2.50008 CCOC(=O)C1=NC2=CC=CC=C2N=C1Cl E55318 [0,0,0,1,0,0|3,0,0]=4 5 B17R2.50008 CCOC(=O)C1=NC2=CC=CN=C2NC1=O E53883 [0,0,0,1,0,0|3,0,0]=4 6 B17R1.5402 CCOC(=O)[C@@H](CCC1=CC=CC=C1)C(C)=O E57811 [0,0,0,0,0,1|0,0,2]=3 7 B14R1.1031 COC(=O)C(C#N)=CC1=CC=CC=C1 M55362 [2,0,0,0,0,0|1,0,1]=4 8 B16R1.743 CCOC(=O)\C(C#N)=C\C1=CC=C(O)C=C1 E55682 [1,1,0,0,0,0|1,0,1]=4 9 B18R1.24250 CCOC(=O)[C@@H](CC1=C(O)C=CC=C1)OC(C)=O E64611 [0,1,0,0,0,1|0,0,2]=4 10 B18R1.24221 CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC D39726 [0,2,0,0,0,0|0,0,2]=4 11 B18R1.24221 CCOC(=O)C(NC1=CC=CC=C1)C(=O)OCC D57039 [0,2,0,0,0,0|1,0,1]=4 12 B16R2.757 CCOC(=O)C1=C(Br)C2=C(C=CC=C2)N1 E54318 [1,0,0,1,0,0|2,0,0]=4 13 B16R2.757 CCOC(=O)C1=C(C)C2=C(C=CC=C2)N1 E55814 [1,0,0,1,0,0|1,0,0]=3 14 B16R2.757 CCOC(=O)C1=C(N)C2=C(C=CC=C2)N1 E5538 [1,0,0,1,0,0|2,0,0]=4 15 B16R2.757 CCOC(=O)C1=C(N)C2=C(C=CC=C2)S1 E54428 [1,0,0,1,0,0|2,0,0]=4 16 B16R2.757 CCOC(=O)C1=C(O)C2=C(C=CC=C2)S1 E67357 [1,0,0,1,0,0|1,0,1]=4 17 B16R2.757 CCOC(=O)[C@@H]1OC2=C(C=CC=C2)C1=O E54365 [1,0,0,1,0,0|1,0,1]=4 18 B16R2.767 CCOC(=O)C1=CC2=CC=CC=C2C=N1 E55662 [1,0,0,1,0,0|1,0,1]=4 19 B16R2.767 CCOC(=O)C1=CC2=CC=CC=C2N=C1 E39006 [1,0,0,1,0,0|1,0,0]=3 20 B16R2.767 CCOC(=O)C1=CC2=CC=CN=C2C=C1 E9598 [1,0,0,1,0,0|1,0,1]=4 21 B16R2.767 CCOC(=O)C1=CC2=CC=NC=C2C=C1 E55663 [1,0,0,1,0,0|1,0,1]=4 22 B16R2.767 CCOC(=O)C1=CC2=CN=CC=C2C=C1 E55664 [1,0,0,1,0,0|1,0,1]=4 23 B16R2.767 CCOC(=O)C1=NC2=CC=CC=C2C=C1 E55660 [1,0,0,1,0,0|1,0,1]=4 24 B16R2.33941 COC(=O)C1=CC2=C(C=CC=C2)NC1=O M10249 [1,0,0,1,0,0|1,0,0]=3 25 B16R2.33941 COC(=O)C1=CC2=CC=CC=C2N=C1Cl M12280 [1,0,0,1,0,0|2,0,0]=4 26 B16R2.33941 COC(=O)C1=CC2=CC=CC=C2N=C1N M54285 [1,0,0,1,0,0|2,0,0]=4 27 B16R2.29842 CCOC(=O)C1=C(C)NC2=C1C=CC=C2 E55813 [0,0,0,1,1,0|1,0,0]=3 28 B16R2.29842 CCOC(=O)C1=C(N)NC2=C1C=CC=C2 E24702 [0,0,0,1,1,0|2,0,0]=4 29 B16R2.29842 CCOC(=O)C1=C(N)NC2=C1C=CC=C2 E5318 [0,0,0,1,1,0|2,0,0]=4 30 B16R2.29842 CCOC(=O)C1=C(N)SC2=C1C=CC=C2 E7794 [0,0,0,1,1,0|1,1,0]=4 31 B18R2.8107 CCOC(=O)C1=C(C)C=C(C2=CC=CC=C2)N1 E57674 [0,0,0,1,0,1|1,0,0]=3 32 B18R2.8107 CCOC(=O)C1=CC(C2=CC=CC=C2)=NN1C E56848 [0,0,0,1,0,1|2,0,0]=4 33 B18R2.81911 CCOC(=O)C1=C(C(=O)O)C2=C(C=CC=C2)N1 E55687 [0,0,0,1,0,1|2,0,0]=4 34 B18R2.81880 CCOC(=O)C1=CC2=CC(Br)=CN=C2NC1=O E12897 [0,1,0,1,0,0|2,0,0]=4 35 B18R2.80684 CCOC(=O)C1=C(N)SC=C1C2=CC=CC=C2 E56823 [0,1,0,1,0,0|1,0,1]=4 36 B18R2.631601 CCOC(=O)C1=CC2=C(Cl)C=CC=C2OC1=O E56541 [0,1,0,1,0,0|1,0,0]=3 37 B18R2.82315 CCOC(=O)C1=C(Cl)C2=CC=CC=C2N=C1Br E56520 [0,1,0,1,0,0|2,0,0]=4 38 B18R2.82315 CCOC(=O)C1=C(O)C2=C(C=CC=C2)NC1=O D12281 [0,1,0,1,0,0|1,0,0]=3 39 B18R2.81826 CCOC(=O)C1=CC2=C(C=C(Br)C=C2)OC1=O E62286 [0,1,0,1,0,0|1,0,0]=3 40 B18R2.81826 CCOC(=O)C1=CC2=C(C=C(F)C=C2)OC1=O E62285 [0,1,0,1,0,0|1,0,0]=3 41 B18R2.81826 CCOC(=O)C1=CC2=C(C=C(O)C=C2)OC1=O E55628 [0,1,0,1,0,0|1,0,0]=3 42 B16R1.5825 COC(=O)\C(=C/C1=CN=CC=C1)CC(=O)O M65597 [1,0,0,0,0,1|2,0,0]=4 43 B16R1.5825 COC(=O)\C(=C\C1=CC=CC=C1)NC(C)=O M55826 [1,0,0,0,0,1|0,0,0]=2