0 B12R1.286 O=CC1=CC(CCO)=CC=C1Cl CS-0094856 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.189 COC1=CC=CC(CCN)=C1 CS-M3354 [1,0,0,0,0,0|0,0,0]=1 2 B11R1.189 N#CC1=CC=CC(CCO)=C1 CS-W023073 [1,0,0,0,0,0|3,0,0]=4 3 B11R1.280 COC1=C(C)C=CC(C=O)=C1 CS-W018927 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.280 COC1=C(F)C=CC(C=O)=C1 CS-W018049 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.280 COC1=C(F)C=CC(CO)=C1 CS-W016238 [1,0,0,0,0,0|2,0,0]=3 6 B11R1.280 COC1=C(N)C=CC(CO)=C1 CS-W006326 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.280 COC1=CC(OC)=C(O)C=C1 CS-W018911 [1,0,0,0,0,0|1,0,0]=2 8 B11R1.280 COC1=CC(OC)=NC=C1Br CS-D0193 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.449 ClCCC1=CC=C2OC=CC2=C1 CS-M0903 [0,0,0,1,0,0|2,0,1]=4 10 B10R1.10 CC1=CC(CNN)=CC=C1 CS-0046882 [2,0,0,0,0,0|1,0,0]=3 11 B10R1.172 CCC1=CC(C=O)=CC=C1 CS-W006593 [2,0,0,0,0,0|2,0,0]=4 12 B10R1.172 CCC1=CC=CC(CC)=N1 CS-W021526 [2,0,0,0,0,0|2,0,0]=4 13 B10R1.172 CNC1=CC(OC)=NC=C1 CS-0080079 [2,0,0,0,0,0|2,0,0]=4 14 B10R1.172 COC1=CC=CC(CN)=C1 CS-W007351 [2,0,0,0,0,0|0,0,0]=2 15 B10R1.172 COC1=CC=CC(NN)=C1 CS-W017475 [2,0,0,0,0,0|1,0,0]=3 16 B10R1.172 COC1=CC=NC(CCl)=C1 CS-0029801 [2,0,0,0,0,0|2,0,0]=4 17 B10R1.172 COC1=NC=CC(CO)=C1 CS-W006559 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.1 CCOC1=CC=C(O)C=C1 CS-W016502 [2,0,0,0,0,0|2,0,0]=4 19 B10R1.1 NCCC1=CC=C(Br)C=C1 CS-W009109 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.176 CN1C=C(CN)C=CC1=O CS-0050768 [2,0,0,0,0,0|1,0,1]=4 21 B10R1.30 COC1=C(Br)C=CC(C)=C1 CS-W004967 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.30 COC1=C(Br)C=CC(F)=C1 CS-W007814 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.30 COC1=C(C)C=CC(N)=C1 CS-W007666 [2,0,0,0,0,0|1,0,0]=3 24 B10R1.30 COC1=C(N)C=CC(Cl)=C1 CS-0043926 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.30 COC1=CC(Br)=CC=C1I CS-W020552 [2,0,0,0,0,0|2,0,0]=4 26 B10R1.30 COC1=CC(Br)=CC=C1N CS-W009042 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.30 COC1=CC(Br)=CC=C1O CS-W007865 [2,0,0,0,0,0|1,0,0]=3 28 B10R1.30 COC1=CC(C)=CC=C1C CS-W023068 [2,0,0,0,0,0|1,0,0]=3 29 B10R1.30 COC1=CC(I)=CC=C1Br CS-0063934 [2,0,0,0,0,0|2,0,0]=4 30 B10R1.30 COC1=CC(I)=CC=C1F CS-0103252 [2,0,0,0,0,0|2,0,0]=4 31 B10R1.30 COC1=CC(N)=NC=C1Br CS-0043022 [2,0,0,0,0,0|2,0,0]=4 32 B10R1.30 COC1=CC(N)=NC=C1Cl CS-0102206 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.30 COC1=CC(N)=NC=C1I CS-0103371 [2,0,0,0,0,0|2,0,0]=4 34 B12R1.41 COC1=CC(N)=CC(CCO)=C1 CS-M0774 [1,1,0,0,0,0|1,0,0]=3 35 B12R1.19 CC(=O)CC1=CC(O)=C(O)C=C1 CS-0047271 [1,1,0,0,0,0|1,0,1]=4 36 B12R1.288 COC1=CC=C(CCN)C=C1O CS-W022238 [1,1,0,0,0,0|0,0,0]=2 37 B12R1.78 COC1=CC=C(C#N)C=C1OC CS-0000029 [1,1,0,0,0,0|0,0,2]=4 38 B12R1.449 COC1=C(O)C=C(Br)C(C=O)=C1 CS-W005482 [1,1,0,0,0,0|1,0,1]=4 39 B12R1.453 COC1=CC=C(O)C(C(C)=O)=C1 CS-D1489 [1,1,0,0,0,0|2,0,0]=4 40 B12R1.654 COC1=C(Cl)C(C=O)=CC=C1O CS-B0144 [1,1,0,0,0,0|1,0,1]=4 41 B12R1.654 COC1=C(O)C(C=O)=CC=C1O CS-0059753 [1,1,0,0,0,0|1,0,1]=4 42 B14R1.3412 COC1=CC(OC(F)(F)F)=CC=C1O CS-0101200 [0,2,0,0,0,0|2,0,0]=4 43 B14R1.3651 COC1=C(OC)C=C(CC(C)O)C=C1 CS-0092697 [0,2,0,0,0,0|1,0,0]=3 44 B14R1.3651 COC1=CC=C(CC(N)=O)C=C1OC CS-M0062 [0,2,0,0,0,0|0,0,1]=3 45 B14R1.6795 COC(=O)C1=CC(CCO)=CC=C1Cl CS-0103004 [0,2,0,0,0,0|2,0,0]=4 46 B14R1.492 CCOC1=CC=C(B(O)O)C(OC)=C1 CS-0101374 [0,2,0,0,0,0|2,0,0]=4 47 B14R1.42 COC1=C(O)C=CC(CC[N+](=O)[O-])=C1 CS-0036988 [0,2,0,0,0,0|0,0,1]=3 48 B12R2.315 COC1=CC=CC2=C1NC=N2 CS-0043995 [1,0,0,1,0,0|1,0,1]=4 49 B12R2.315 N#CC1=CC=CC2=C1NCC2 CS-B0547 [1,0,0,1,0,0|2,0,0]=4 50 B12R2.100 CC1=CC2=C(C=C1O)NN=C2 CS-0054507 [1,0,0,1,0,0|1,0,1]=4 51 B12R2.100 OC1=CC2=C(C=C1O)NC=C2 CS-W018811 [1,0,0,1,0,0|0,0,2]=4 52 B14R2.2167 COC1=CC2=C(C=C1O)CCC2=O CS-0036628 [0,1,0,1,0,0|1,0,1]=4 53 B14R2.112 CNCC1=CC=C2OCCOC2=C1 CS-0037876 [0,1,0,1,0,0|2,0,0]=4 54 B14R2.82 COC1=CC2=C(C=C1OC)CNC2 CS-0101431 [0,1,0,1,0,0|2,0,0]=4 55 B14R2.1416 COC1=CC2=C(C=C1F)C(=O)CC2 CS-0101689 [0,1,0,1,0,0|2,0,0]=4 56 B14R2.1416 COC1=CC2=C(C=C1O)C(=O)CC2 CS-0036171 [0,1,0,1,0,0|1,0,0]=3