0 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 CS-0045366 [0,0,0,0,0,0|2,0,0]=2 1 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 CS-W014727 [1,0,0,0,0,0|2,0,0]=3 2 B13R2.57 C#CC1=CC=C2N=CC=CC2=C1 CS-0102197 [1,0,0,0,0,0|1,0,2]=4 3 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 CS-0040289 [1,0,0,0,0,0|2,0,0]=3 4 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 CS-W018759 [1,0,0,0,0,0|1,0,0]=2 5 B13R2.57 NCC1=CC=C2N=CC=NC2=C1 CS-0093270 [1,0,0,0,0,0|3,0,0]=4 6 B13R2.57 O=CC1=CC2=CC=CC=C2C=N1 CS-0006090 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 CS-W008168 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.57 OCC1=CC2=C(C=C1)C=NC=C2 CS-0021456 [1,0,0,0,0,0|2,0,0]=3 9 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 CS-0044957 [1,0,0,0,0,0|2,0,0]=3 10 B15R2.1601 COC(=O)C1=CC2=C(C=C1)C=NC=C2 CS-0021457 [0,1,0,0,0,0|3,0,0]=4 11 B15R2.1601 COC(=O)C1=CC2=CC=CC=C2N=C1 CS-0097864 [0,1,0,0,0,0|3,0,0]=4 12 B15R2.1601 COC(=O)C1=NC2=CC=CC=C2C=C1 CS-W016857 [0,1,0,0,0,0|3,0,0]=4 13 B13R1.470 CCOC(=O)CC1=CC=CC=C1I CS-0041136 [0,0,1,0,0,0|2,0,1]=4 14 B13R2.449 ClCCC1=CC=C2OC=CC2=C1 CS-M0903 [0,0,0,0,1,0|3,0,0]=4 15 B13R2.449 OCCC1=CC2=C(C=C1)SC=C2 CS-0056514 [0,0,0,0,1,0|3,0,0]=4 16 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 CS-W007403 [2,0,0,0,0,0|2,0,0]=4 17 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 CS-W007480 [2,0,0,0,0,0|2,0,0]=4 18 B12R2.24 ClC1=CC=C2C=CN=CC2=C1 CS-W007219 [2,0,0,0,0,0|2,0,0]=4 19 B12R2.24 FC1=CC=C2C=NC=CC2=C1 CS-W019741 [2,0,0,0,0,0|2,0,0]=4 20 B12R2.24 FC1=NC2=CC=CC=C2C=C1 CS-D1247 [2,0,0,0,0,0|2,0,0]=4 21 B12R2.24 IC1=NC2=C(C=CC=C2)C=C1 CS-0037774 [2,0,0,0,0,0|2,0,0]=4 22 B12R2.24 NC1=CC=C2C=CN=CC2=C1 CS-W018610 [2,0,0,0,0,0|2,0,0]=4 23 B12R2.24 NC1=CC=C2C=NC=CC2=C1 CS-W019654 [2,0,0,0,0,0|2,0,0]=4 24 B12R2.24 O=C1C=CC2=CC=CC=C2N1 CS-W005598 [2,0,0,0,0,0|1,0,1]=4 25 B12R2.24 OC1=CC2=C(C=C1)N=CC=N2 CS-W006283 [2,0,0,0,0,0|2,0,0]=4 26 B12R2.24 OC1=CC2=C(C=CC=N2)C=C1 CS-W007889 [2,0,0,0,0,0|1,0,0]=3 27 B12R2.24 OC1=CC=C2N=CC=CC2=C1 CS-W007818 [2,0,0,0,0,0|1,0,0]=3 28 B14R1.32 CCOC(=O)\C=C\C1=CC(O)=CC=C1 CS-0047066 [0,1,1,0,0,0|1,0,0]=3 29 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 CS-W021127 [0,1,1,0,0,0|1,0,0]=3 30 B14R1.598 CCOC(=O)\C=C\C1=CC=CC=C1F CS-0046904 [0,1,1,0,0,0|1,0,0]=3 31 B14R2.92 O=CC1=C(O)C2=CC=CC=C2C=C1 CS-0060583 [1,1,0,0,0,0|1,0,1]=4 32 B14R2.134 COC1=CC=C2N=CC(Br)=CC2=C1 CS-W021877 [1,1,0,0,0,0|1,0,0]=3 33 B14R2.134 COC1=NC2=CC(Br)=CC=C2C=C1 CS-W022528 [1,1,0,0,0,0|1,0,0]=3 34 B14R2.142 COC1=CC=C2C=CC=C(O)C2=C1 CS-W022550 [1,1,0,0,0,0|0,0,0]=2 35 B14R2.781 CC(C)C1=CC2=C(C=C1)C=NC=C2 CS-0095307 [1,1,0,0,0,0|1,0,0]=3 36 B14R2.781 CC(N)C1=CC=C2C=CC=CC2=C1 CS-M1070 [1,1,0,0,0,0|0,0,0]=2 37 B14R2.781 FC(F)C1=CC2=C(C=CC=N2)C=C1 CS-0037130 [1,1,0,0,0,0|2,0,0]=4 38 B14R2.1019 COC1=CC(Br)=C2C=CC=CC2=C1 CS-0105422 [1,1,0,0,0,0|0,0,0]=2 39 B14R2.1019 COC1=CC(Br)=C2C=CC=NC2=C1 CS-B0551 [1,1,0,0,0,0|1,0,0]=3 40 B14R2.1801 COC1=CC2=NC=NC(Cl)=C2C=C1 CS-D0278 [1,1,0,0,0,0|2,0,0]=4 41 B14R2.1801 COC1=CC=C2C(N)=CC=NC2=C1 CS-0107018 [1,1,0,0,0,0|1,0,0]=3 42 B14R2.1801 COC1=NC=C2C(Cl)=CC=NC2=C1 CS-D0453 [1,1,0,0,0,0|2,0,0]=4 43 B14R2.2332 COC1=CC=C2N=C(Cl)C=CC2=C1 CS-W008577 [1,1,0,0,0,0|1,0,0]=3 44 B14R2.2332 N#CC1=CC=C2C=C(Br)C=CC2=C1 CS-0046316 [1,1,0,0,0,0|1,0,1]=4 45 B14R2.2332 OCC1=CC2=CC=C(Br)C=C2C=C1 CS-0046891 [1,1,0,0,0,0|1,0,0]=3 46 B16R2.33887 COC(=O)C1=CC(O)=C2C=CC=CC2=C1 CS-B0396 [0,2,0,0,0,0|2,0,0]=4 47 B16R2.33941 COC(=O)C1=CC2=CC=CC=C2C=C1O CS-0070675 [0,2,0,0,0,0|2,0,0]=4 48 B16R2.28261 CCOC1=CC=C2N=CC(Br)=C(Cl)C2=C1 CS-0061650 [0,2,0,0,0,0|1,0,0]=3 49 B16R2.28261 CCOC1=CC=C2N=CC(Br)=C(O)C2=C1 CS-0061651 [0,2,0,0,0,0|1,0,0]=3 50 B16R2.33799 COC(=O)C1=CC=C2C=C(N)C=CC2=C1 CS-0101347 [0,2,0,0,0,0|2,0,0]=4 51 B16R2.82802 CC(C)(N)CC1=CC2=CC=CC=C2C=C1 CS-M0687 [0,2,0,0,0,0|1,0,0]=3 52 B16R3.13490 BrC1=CC2=C(N=NO2)C3=CC=CC=C13 CS-B1386 [0,1,0,1,0,0|2,0,0]=4 53 B12R2.32 OCC1=CC2=CC=CC=C2N1 CS-W004828 [1,0,0,0,1,0|2,0,0]=4 54 B12R2.44 COC1=CN=C2NC=CC2=C1 CS-B0501 [1,0,0,0,1,0|2,0,0]=4 55 B12R2.44 COC1=NC2=C(C=C1)NC=C2 CS-W008514 [1,0,0,0,1,0|2,0,0]=4 56 B12R2.44 NCC1=CC2=C(C=CN2)C=C1 CS-0030456 [1,0,0,0,1,0|2,0,0]=4 57 B14R1.520 CCOC(=O)\C=C\CC1=CC=CC=C1 CS-0047024 [0,0,1,0,0,1|1,0,0]=3