0 B12R1.77 CNC1=CC=CC=C1C(=O)NN DP01747 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.77 COC(=O)C1=CC=CN=C1SC BTB06827 [0,0,0,0,0,0|1,1,0]=2 2 B11R1.53 COC1=NC=CC=C1C(=O)O KM01841 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] SPB06058 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.53 CSC1=NC=CC=C1C(=O)O BTB06287 [1,0,0,0,0,0|1,1,0]=3 5 B11R1.53 CSC1=NC=CC=C1C(N)=O BTB06434 [1,0,0,0,0,0|2,1,0]=4 6 B11R1.222 CNC(=O)C1=C(I)C=CC=C1 NRB00705 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.222 COC(=O)C1=NC=CN=C1N SEW03162 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.222 NNC(=O)C1=CC=CC=C1Br RDP00172 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.222 NNC(=O)C1=CC=CC=C1O SEW04563 [1,0,0,0,0,0|2,0,0]=3 10 B13R1.89 CSC1=NC=CC=C1C(=O)N(C)C BTB06828 [0,1,0,0,0,0|2,1,0]=4 11 B13R1.547 COC(=O)C1=CC=NC=C1C(=O)O BTB07951 [0,1,0,0,0,0|3,0,0]=4 12 B13R1.2209 CNC1=C(C(=O)NN)C=C(Cl)C=C1 DP01825 [0,1,0,0,0,0|3,0,0]=4 13 B13R2.32 CC1=COC2=CC=CC=C2C1=O BTB12529 [0,0,0,1,0,0|1,0,1]=3 14 B13R2.32 CN1N=CC2=CC=CC=C2C1=O DP00854 [0,0,0,1,0,0|3,0,0]=4 15 B13R2.32 O=C1C(Br)=COC2=C1C=CC=C2 RF01262 [0,0,0,1,0,0|2,0,1]=4 16 B13R2.582 COC1=CC=CC2=C1C(N)=NO2 MO00345 [0,0,0,1,0,0|3,0,0]=4 17 B11R1.59 COC(=O)C1=C(OC)C=CS1 GK02497 [0,0,0,0,1,0|1,0,0]=2 18 B11R1.59 COC(=O)C1=CSC=C1OC KM00444 [0,0,0,0,1,0|1,0,0]=2 19 B11R1.59 COC1=CSC=C1C(=O)NN KM04436 [0,0,0,0,1,0|3,0,0]=4 20 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 RDP00161 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.61 O=C(O)C1=CC=CC=C1I BTB05694 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.61 O=C(O)C1=CC=CN=C1S SB00659 [2,0,0,0,0,0|1,1,0]=4 23 B12R1.46 CNC1=C(C(N)=O)C=C(Cl)C=C1 BTB01822 [1,1,0,0,0,0|2,0,0]=4 24 B12R1.354 CNC(=O)C1=C(I)C=CC(C)=C1 RJC00414 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.354 CNC(=O)C1=C(I)C=CC(Cl)=C1 RJC00416 [1,1,0,0,0,0|2,0,0]=4 26 B12R1.291 CCOC1=C(C(=O)OC)SC=C1 GK02484 [0,1,0,0,1,0|1,0,0]=3 27 B12R1.743 COC(=O)C1=C(OC)C(Br)=CS1 GK02499 [0,1,0,0,1,0|1,0,0]=3 28 B14R1.965 COC1=CC=CC=C1NC(=O)\C=N\O BTB05719 [0,1,0,0,0,1|2,0,0]=4 29 B14R1.3136 C\N=C(\NC1=C(OC)C=CC=C1)SC RDR01994 [0,1,0,0,0,1|1,1,0]=4 30 B14R1.789 COC(=O)C1=CC=CC=C1N\C=N\O CD11684 [0,2,0,0,0,0|1,0,1]=4 31 B14R1.789 COC(=O)C1=CC=CC=C1SCC#N KM00945 [0,2,0,0,0,0|0,1,0]=3 32 B14R1.2334 CCC(=O)C1=CC=C(OC)C=C1OC BTB12500 [0,2,0,0,0,0|1,0,0]=3 33 B14R1.2167 COC1=CC=CC(OC)=C1C(=O)NN CD11636 [0,2,0,0,0,0|2,0,0]=4 34 B12R2.2028 CN1SC(=O)C2=C1C=CC=C2 BTB03211 [1,0,0,1,0,0|1,1,0]=4 35 B14R2.95 COC(=O)C1=CNC2=C1C=CC=C2 AC30928 [0,0,0,1,0,1|1,0,1]=4 36 B14R2.10782 COC(=O)C1=CC=CC2=C1NC=C2 BTB12321 [0,1,0,1,0,0|1,0,1]=4 37 B14R2.1146 COC1=CC(=O)OC2=CC=CC=C12 S11995 [0,1,0,1,0,0|1,0,1]=4 38 B14R2.52 O=C1COC2=CC=CC=C2C(=O)N1 BTB12993 [0,1,0,1,0,0|1,0,1]=4 39 B14R2.215 CON1C(=O)C2=CC=CC=C2C1=O XBX00238 [0,1,0,1,0,0|2,0,0]=4 40 B10R1.39 COC1=CSC=C1C(=O)O KM00448 [1,0,0,0,1,0|1,0,0]=3 41 B10R1.39 COC1=CSC=C1C(N)=O KM01620 [1,0,0,0,1,0|2,0,0]=4 42 B10R1.149 COC(=O)C1=C(Br)C=CS1 SEW02691 [1,0,0,0,1,0|2,0,0]=4 43 B10R1.149 COC(=O)C1=C(N)C=CS1 SB01239 [1,0,0,0,1,0|2,0,0]=4 44 B10R1.149 COC(=O)C1=C(N)SC=C1 GK02784 [1,0,0,0,1,0|2,0,0]=4 45 B10R1.149 COC(=O)C1=C(O)C=CS1 SB01952 [1,0,0,0,1,0|1,0,0]=3