0 B12R1.270 CCOC1=CC(C#N)=CC=C1O CS-Z0025 [0,0,0,0,0,0|1,0,1]=2 1 B12R1.270 CCOC1=CC(C=O)=CC=C1Br CS-0041871 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 CS-W008227 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.280 COC1=C(Br)C=CC(C=O)=C1 CS-W005212 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.280 COC1=C(N)C=CC(C#N)=C1 CS-W006078 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.280 COC1=CC(C#N)=CC=C1O CS-0046224 [1,0,0,0,0,0|1,0,1]=3 6 B13R1.354 CCOC1=C(F)C=CC(B(O)O)=C1 CS-0038629 [0,1,0,0,0,0|2,0,1]=4 7 B13R1.354 CCOC1=CC(B(O)O)=CC=C1Cl CS-0042905 [0,1,0,0,0,0|2,0,1]=4 8 B13R1.355 CCOC1=CC(C=O)=CC=C1OC CS-M2547 [0,1,0,0,0,0|0,0,0]=1 9 B13R1.2431 COC(=O)C1=CC(C=O)=CC=C1O CS-D1358 [0,1,0,0,0,0|2,0,0]=3 10 B13R2.57 C(=O)C1=CC=C2OCCOC2=C1 CS-D1456 [0,0,0,1,0,0|0,0,0]=1 11 B13R2.57 OCC1=CC=C2OCCOC2=C1 CS-0036298 [0,0,0,1,0,0|0,0,2]=3 12 B10R1.30 CCC1=CC(Br)=CC=C1F CS-W022093 [2,0,0,0,0,0|2,0,0]=4 13 B10R1.30 CCC1=CC(Br)=CC=C1N CS-M2231 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.30 COC1=C(Br)C=CC(O)=C1 CS-W008128 [2,0,0,0,0,0|1,0,1]=4 15 B10R1.30 COC1=C(C)C=CC(Br)=C1 CS-W008193 [2,0,0,0,0,0|2,0,0]=4 16 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 CS-W005884 [2,0,0,0,0,0|2,0,0]=4 17 B10R1.30 COC1=C(Cl)C=CC(N)=C1 CS-W016214 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.30 COC1=C(F)C=CC(N)=C1 CS-W005619 [2,0,0,0,0,0|2,0,0]=4 19 B10R1.30 COC1=C(O)C=CC(N)=C1 CS-W008263 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.30 COC1=CC(Br)=CC=C1Br CS-0040073 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.30 COC1=CC(C)=CC=C1N CS-W021709 [2,0,0,0,0,0|1,0,1]=4 22 B10R1.30 COC1=CC(C)=CC=C1O CS-W021711 [2,0,0,0,0,0|0,0,1]=3 23 B10R1.30 COC1=CC(Cl)=CC=C1N CS-0042669 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.30 COC1=CC(Cl)=CC=C1O CS-0096842 [2,0,0,0,0,0|1,0,0]=3 25 B10R1.30 COC1=CC(I)=CC=C1Cl CS-0041284 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.30 COC1=NC(Br)=CC=C1O CS-0046307 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.30 OCC1=CC(Br)=CC=C1O CS-W015481 [2,0,0,0,0,0|2,0,0]=4 28 B10R1.172 COC1=CC=CC(C=O)=C1 CS-W007346 [2,0,0,0,0,0|0,0,0]=2 29 B10R1.172 COC1=NC=CC(C=O)=C1 CS-D1632 [2,0,0,0,0,0|1,0,0]=3 30 B10R1.172 COC1=NC=CC(C=O)=N1 CS-W006622 [2,0,0,0,0,0|2,0,0]=4 31 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 CS-W018591 [2,0,0,0,0,0|1,0,0]=3 32 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 CS-W007483 [2,0,0,0,0,0|1,0,0]=3 33 B10R1.176 O=CC1=CC(Cl)=C(Br)C=C1 CS-W005655 [2,0,0,0,0,0|2,0,0]=4 34 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 CS-W007504 [2,0,0,0,0,0|2,0,0]=4 35 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 CS-W007521 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.176 O=CC1=CC(F)=C(O)C=C1 CS-W014392 [2,0,0,0,0,0|1,0,0]=3 37 B10R1.176 O=CC1=CC=C(F)C(Br)=C1 CS-B1308 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.176 O=CC1=CC=C(I)C(O)=C1 CS-0038831 [2,0,0,0,0,0|1,0,0]=3 39 B12R1.279 CCOC1=CC(C(=O)O)=CC=C1 CS-0100628 [1,1,0,0,0,0|0,0,0]=2 40 B12R1.279 CCOC1=CC([N+](=O)[O-])=CC=C1 CS-B0032 [1,1,0,0,0,0|1,0,0]=3 41 B12R1.438 O=CC1=CC=CC(OC(F)F)=C1 CS-0044442 [1,1,0,0,0,0|1,0,0]=3 42 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 CS-W017876 [1,1,0,0,0,0|1,0,0]=3 43 B12R1.56 COC1=CC(B(O)O)=CC=C1O CS-0044961 [1,1,0,0,0,0|1,0,1]=4 44 B12R1.56 COC1=CC(C(=O)O)=CC=C1N CS-M0329 [1,1,0,0,0,0|1,0,0]=3 45 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1Br CS-W014685 [1,1,0,0,0,0|2,0,0]=4 46 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1C CS-W017839 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1O CS-W005249 [1,1,0,0,0,0|1,0,0]=3 48 B12R1.56 O=C(O)C1=CC=C(Br)C(CO)=C1 CS-W022098 [1,1,0,0,0,0|2,0,0]=4 49 B12R1.78 COC1=C(OC)C=C(NN)C=C1 CS-W006381 [1,1,0,0,0,0|2,0,0]=4 50 B12R1.78 COC1=CC(OC)=C(CO)C=C1 CS-W007584 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.300 COC1=C(O)C(O)=CC(C=O)=C1 CS-0043430 [1,1,0,0,0,0|0,0,0]=2 52 B12R1.449 COC1=C(Br)C=C(F)C(C=O)=C1 CS-0089647 [1,1,0,0,0,0|1,0,0]=3 53 B12R1.449 COC1=C(F)C=C(Br)C(C=O)=C1 CS-0097503 [1,1,0,0,0,0|1,0,0]=3 54 B12R1.453 O=CC1=CC=C(O)C([N+](=O)[O-])=C1 CS-W019280 [1,1,0,0,0,0|2,0,0]=4 55 B14R1.441 CCOC1=CC(C(N)=O)=CC=C1OC CS-Z0024 [0,2,0,0,0,0|0,0,0]=2 56 B14R1.5389 CCCC1=C(O)C(C(C)=O)=CC=C1O CS-M0927 [0,2,0,0,0,0|1,0,0]=3 57 B14R1.2315 COC(=O)C1=CC(C=O)=CC=C1OC CS-M3114 [0,2,0,0,0,0|2,0,0]=4 58 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 CS-W008084 [1,0,0,1,0,0|2,0,0]=4 59 B12R2.24 BrC1=CC=C2CCCOC2=C1 CS-0028282 [1,0,0,1,0,0|2,0,0]=4 60 B12R2.44 O=CC1=CC=C2N=COC2=C1 CS-W006738 [1,0,0,1,0,0|1,0,1]=4 61 B12R2.315 O=CC1=C2OCOC2=CC=C1 CS-0043988 [1,0,0,1,0,0|1,0,0]=3 62 B14R2.601 CC1=NC2=CC(C(=O)O)=CC=C2O1 CS-D0089 [0,1,0,1,0,0|1,0,1]=4 63 B14R2.781 CC(=O)C1=CC2=C(C=C1)NCCC2 CS-B1053 [0,1,0,1,0,0|2,0,0]=4 64 B14R2.781 CC(=O)C1=CC=C2OCCOC2=C1 CS-W019478 [0,1,0,1,0,0|0,0,0]=2 65 B14R2.781 O=C(O)C1=CC2=C(C=C1)NCCC2 CS-W006431 [0,1,0,1,0,0|2,0,0]=4