0 B10R1.20 COC1=C(C=O)C=CC=N1 SPC-g793 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.20 COC1=NC=CC=C1CN SPC-j644 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.20 COC1=NC=CC=C1CO SPC-j643 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.15 CC1=C(C#N)C=CC=N1 SPC-j817 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.15 CC1=C(C=O)C=CC=N1 SPC-m999 [1,0,0,0,0,0|2,0,1]=4 5 B9R1.15 CC1=C(CBr)C=CC=N1 SPC-s887 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.15 CC1=C(CN)N=NC=C1 SPC-s731 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.15 CC1=CC=CN=C1C#N SPC-m683 [1,0,0,0,0,0|2,0,1]=4 8 B9R1.15 CC1=NC=CN=C1CCl SPC-r108 [1,0,0,0,0,0|1,0,0]=2 9 B9R1.15 CC1=NC=CN=C1CO SPC-m052 [1,0,0,0,0,0|1,0,0]=2 10 B9R1.15 CCC1=C(F)C=NC=N1 SPC-k117 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.15 COC1=NC=CC=C1N SPC-t771 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.15 ClCC1=CC=CN=C1Cl SPC-h092 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.15 N#CC1=NC=CN=C1Cl SPC-g100 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.15 NC1=NC=CN=C1C=O SPC-j177 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.15 NCC1=C(Cl)C=CC=N1 SPC-u229 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.15 NCC1=C(F)C=CC=N1 SPC-j562 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.15 NCC1=C(F)C=CC=N1 SPC-t905 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.15 OCC1=C(F)C=CC=N1 SPC-h122 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.15 OCC1=CC=CN=C1Cl SPC-g018 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.15 OCC1=NC=CN=C1Cl SPC-m584 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.37 COC1=NC=C(Br)C=C1CO SPC-j667 [0,1,0,0,0,0|3,0,0]=4 22 B11R1.37 COC1=NC=C(F)C=C1CO SPC-v142 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.53 CC(C)C1=C(CBr)C=CC=C1 SPC-m453 [0,1,0,0,0,0|3,0,0]=4 24 B11R2.1 CC1=NNC2=NC=CN=C12 SPC-k120 [0,0,0,1,0,0|2,0,1]=4 25 B11R2.1 O=C1CCC2=C1C=CC=N2 SPC-n233 [0,0,0,1,0,0|2,0,1]=4 26 B11R2.20 C1=CC2=C(C=C1)CNCC2 SPC-t693 [0,0,0,1,0,0|3,0,0]=4 27 B11R2.20 C1=CN=C2CCNCC2=C1 SPC-u452 [0,0,0,1,0,0|2,0,0]=3 28 B11R2.20 C1=CN=C2CNCCC2=C1 SPC-p618 [0,0,0,1,0,0|2,0,0]=3 29 B11R2.20 C1=NC=C2CCNCC2=N1 SPC-p704 [0,0,0,1,0,0|3,0,0]=4 30 B8R1.2 C#CC1=NC=CN=C1 SPC-v626 [2,0,0,0,0,0|0,0,2]=4 31 B8R1.2 ClCC1=NC=CN=C1 SPC-i698 [2,0,0,0,0,0|1,0,0]=3 32 B8R1.2 NCC1=NC=CN=C1 SPC-j017 [2,0,0,0,0,0|1,0,0]=3 33 B8R1.2 NNC1=NC=CN=C1 SPC-g338 [2,0,0,0,0,0|2,0,0]=4 34 B8R1.2 O=CC1=NC=CN=C1 SPC-j095 [2,0,0,0,0,0|1,0,1]=4 35 B8R1.2 OCC1=CN=CC=C1 SPC-g084 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.2 OCC1=NC=CN=C1 SPC-g622 [2,0,0,0,0,0|1,0,0]=3 37 B8R1.5 CC1=C(Br)C=CC=N1 SPC-s912 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.5 CC1=C(O)C=CC=N1 SPC-g264 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.5 CC1=CC=CN=C1Br SPC-g509 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.5 CC1=CC=CN=C1Cl SPC-k262 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.5 CC1=NC=CN=C1N SPC-s947 [2,0,0,0,0,0|1,0,0]=3 42 B10R1.4 N#CCC1=NC=CN=C1Cl SPC-m050 [1,1,0,0,0,0|1,0,1]=4 43 B10R1.4 NCCC1=C(Br)C=CC=N1 SPC-k820 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.4 OCCC1=C(F)C=CC=N1 SPC-p080 [1,1,0,0,0,0|2,0,0]=4 45 B10R1.25 CCC1=NC=C(Br)C=C1N SPC-n189 [1,1,0,0,0,0|2,0,0]=4 46 B10R1.25 CSC1=NC=C(Cl)N=C1Cl SPC-p306 [1,1,0,0,0,0|2,0,0]=4 47 B10R1.30 CC1=NC=C(Br)C=C1CO SPC-t488 [1,1,0,0,0,0|2,0,0]=4 48 B10R1.61 CC(=O)C1=NC=CN=C1Cl SPC-m051 [1,1,0,0,0,0|1,0,1]=4 49 B10R1.61 CC(C)C1=CC=CN=C1N SPC-s895 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.61 CC1=NC=CN=C1C(=O)O SPC-j734 [1,1,0,0,0,0|1,0,1]=4 51 B10R1.245 COC1=C(Cl)C=CN=C1C SPC-m314 [1,1,0,0,0,0|2,0,0]=4 52 B10R2.7 C1=CN=C2CNCC2=C1 SPC-n234 [1,0,0,1,0,0|2,0,0]=4 53 B10R2.7 C1=CN=C2NCCC2=C1 SPC-g235 [1,0,0,1,0,0|2,0,0]=4 54 B12R2.24 BrC1=CN=C2CCNCC2=C1 SPC-j855 [0,1,0,1,0,0|2,0,0]=4 55 B12R2.24 BrC1=CN=C2CNCCC2=C1 SPC-v278 [0,1,0,1,0,0|2,0,0]=4 56 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 SPC-t670 [0,1,0,1,0,0|2,0,0]=4 57 B12R2.1081 O=C1CCCC2=C1C=CC=N2 SPC-h229 [0,1,0,1,0,0|1,0,1]=4 58 B12R2.2403 CC1(C)CNC2=NC=CC=C21 SPC-p297 [0,1,0,1,0,0|2,0,0]=4 59 B8R1.11 CCN1N=CC=C1N SPC-g728 [1,0,0,0,1,0|2,0,0]=4 60 B8R1.11 CN1C=CN=C1CN SPC-u748 [1,0,0,0,1,0|2,0,0]=4