0 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)N1 CS-0880099 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.328 CC1=NC2=CC=CC=C2C(=O)O1 CS-0046639 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.328 CC1CC(=O)C2=C(C=CC=C2)N1 CS-0038167 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.328 CC1CC(=O)C2=CC=CC=C2S1 CS-0260523 [0,0,0,0,0,0|3,1,0]=4 4 B13R2.328 O=C1CC(=O)C2=C(C=CC=C2)N1 CS-0104588 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.24 OC1=CC2=C(C=CC=C2)C=N1 CS-0166779 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.24 OC1CC2=C(C=CC=C2)CO1 CS-0162771 [1,0,0,0,0,0|2,0,1]=4 7 B12R2.1081 O=C1C=CCC2=CC=CC=C12 CS-0007617 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.1081 O=C1CNNC2=CC=CC=C12 CS-0188108 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.1081 O=C1CSCC2=CC=CC=C12 CS-0063869 [1,0,0,0,0,0|3,0,0]=4 10 B14R2.8235 CC1=NC2=C(C=C(Br)C=C2)C(=O)O1 CS-0206309 [0,1,0,0,0,0|3,0,0]=4 11 B14R2.8235 CC1CC(=O)C2=C(C=CC(F)=C2)O1 CS-0314473 [0,1,0,0,0,0|3,0,0]=4 12 B14R2.28480 C[C@H]1CC2=CC=CC(O)=C2C(=O)O1 CS-0135966 [0,1,0,0,0,0|3,0,0]=4 13 B14R2.28480 O=C1CC2=C(C(=O)O1)C(O)=CC=C2 CS-0522671 [0,1,0,0,0,0|2,0,1]=4 14 B14R2.29365 CC1=CC(=O)C2=CC=C(N)C=C2O1 CS-1084548 [0,1,0,0,0,0|3,0,0]=4 15 B14R2.29365 NC1=CC2=C(C=C1)C(=O)OC(=O)N2 CS-0200050 [0,1,0,0,0,0|2,0,1]=4 16 B14R2.29496 CC1(C)NC(=O)C2=C(C=CC=C2)O1 CS-0038020 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.75 CC(=O)OC1=CC=CC=C1C=O CS-0099717 [0,0,1,0,0,0|2,0,1]=4 18 B12R1.107 OB(O)\C=C(/Br)C1=CC=CC=C1 CS-0941979 [0,0,1,0,0,0|3,0,0]=4 19 B12R1.283 C=CCC1=CC=CC=C1C(=O)O CS-0029665 [0,0,1,0,0,0|3,0,0]=4 20 B12R1.283 CCNC1=C(C(=O)O)C=CC=C1 CS-0070497 [0,0,1,0,0,0|3,0,0]=4 21 B12R1.283 CCOC1=CN=CC=C1C(=O)O CS-0043812 [0,0,1,0,0,0|3,0,0]=4 22 B12R1.283 CCSC1=C(C(=O)O)C=CC=C1 CS-0073246 [0,0,1,0,0,0|2,1,0]=4 23 B12R1.283 COCC1=CC=CC=C1C(=O)O CS-0150188 [0,0,1,0,0,0|3,0,0]=4 24 B12R1.283 N#CCC1=CC=CC=C1C(=O)O CS-0206462 [0,0,1,0,0,0|3,0,0]=4 25 B12R1.308 C=COC(=O)C1=CC=CC=C1Cl CS-0167835 [0,0,1,0,0,0|3,0,0]=4 26 B12R1.308 CCCC(=O)C1=CC=CC=C1O CS-0152466 [0,0,1,0,0,0|3,0,0]=4 27 B12R1.308 CCNC(=O)C1=C(O)C=CC=C1 CS-0037834 [0,0,1,0,0,0|3,0,0]=4 28 B12R1.308 CCOC(=O)C1=C(O)C=CC=N1 CS-0043811 [0,0,1,0,0,0|3,0,0]=4 29 B12R1.308 CCOC(=O)C1=CN=CC=C1O CS-0089684 [0,0,1,0,0,0|3,0,0]=4 30 B12R1.308 O=C(CCCl)C1=CC=CC=C1O CS-0516331 [0,0,1,0,0,0|3,0,0]=4 31 B12R2.18 CN1SC2=C(C=CC=C2)C1=O CS-0155480 [0,0,0,0,1,0|2,1,0]=4 32 B12R2.18 O=C1C2=C(C=CC=C2)CC1F CS-0242886 [0,0,0,0,1,0|3,0,0]=4 33 B12R2.2028 NC1=NC(=O)C2=C1C=CC=C2 CS-0227427 [0,0,0,0,1,0|3,0,0]=4 34 B12R2.2028 O=C1OC(Br)C2=C1C=CC=C2 CS-0044779 [0,0,0,0,1,0|2,0,0]=3 35 B14R2.52 O=C1COC2=CC=CC=C2C(=O)N1 CS-0247128 [0,0,0,0,0,1|2,0,1]=4 36 B11R1.16 CNOC(=O)C1=CC=CC=C1 CS-0328164 [1,0,1,0,0,0|2,0,0]=4 37 B11R1.16 O=C(NCO)C1=CC=CC=C1 CS-0116997 [1,0,1,0,0,0|2,0,0]=4 38 B11R1.53 C=CC1=CC=CC=C1C(=O)O CS-0313033 [1,0,1,0,0,0|2,0,0]=4 39 B11R1.53 COC1=C(S(=O)O)C=CC=C1 CS-1019646 [1,0,1,0,0,0|2,0,0]=4 40 B11R1.53 NNC1=CC=CC=C1C(=O)O CS-0666897 [1,0,1,0,0,0|2,0,0]=4 41 B11R1.222 NCC(=O)C1=CC=CC=C1O CS-0510997 [1,0,1,0,0,0|2,0,0]=4 42 B11R1.222 N\C(=N/O)C1=CC=CC=C1O CS-0173165 [1,0,1,0,0,0|2,0,0]=4 43 B11R1.222 O=C(CBr)C1=CC=CC=C1O CS-0040449 [1,0,1,0,0,0|2,0,0]=4 44 B11R1.222 O=C(NO)C1=CC=CC=C1Br CS-0108617 [1,0,1,0,0,0|2,0,0]=4 45 B11R1.222 [Li]OC(=O)C1=CC=CC=C1O CS-0013649 [1,0,1,0,0,0|1,0,0]=3 46 B13R1.141 CCOC1=C(C(=O)O)C=C(C)C=C1 CS-0183669 [0,1,1,0,0,0|2,0,0]=4 47 B13R1.356 CCOC1=C(C(=O)O)C=CC(F)=C1 CS-0151492 [0,1,1,0,0,0|2,0,0]=4 48 B13R1.356 CCOC1=CC(Cl)=CC=C1C(=O)O CS-0232703 [0,1,1,0,0,0|2,0,0]=4 49 B13R1.572 COCOC1=CC=CC=C1C(C)=O CS-0357598 [0,1,1,0,0,0|2,0,0]=4 50 B13R1.572 N#CCOC1=CC=CC=C1C(=O)O CS-0250839 [0,1,1,0,0,0|2,0,0]=4 51 B13R1.572 O=C(O)C1=CC=CC=C1OCCO CS-0250823 [0,1,1,0,0,0|1,0,0]=3 52 B13R1.572 O=C(O)C1=CC=CC=C1SCCO CS-0261515 [0,1,1,0,0,0|1,1,0]=4 53 B13R1.446 CCOC(=O)C1=C(O)C=CC(Br)=C1 CS-0312692 [0,1,1,0,0,0|2,0,0]=4 54 B13R2.4818 O=C1C=COC2=C1C(O)=CC=C2 CS-0236015 [1,1,0,0,0,0|2,0,0]=4 55 B13R2.45 O=C1C2=CC=CC=C2C\C1=N\O CS-0236575 [0,1,0,0,1,0|2,0,0]=4 56 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)O1 CS-0071890 [0,1,0,0,1,0|2,0,0]=4 57 B13R2.243 CC1(C)OC2=CC=CC=C2C1=O CS-0464195 [0,1,0,0,1,0|2,0,0]=4 58 B13R2.2931 COC1OC(=O)C2=CC=CC=C21 CS-0186840 [0,1,0,0,1,0|1,0,0]=3 59 B13R2.2931 CO[IH2]1OC(=O)C2=CC=CC=C21 CS-0449195 [0,1,0,0,1,0|1,0,0]=3 60 B13R2.5187 O=C1OC(O)C2=C1C=CC(Br)=C2 CS-0335651 [0,1,0,0,1,0|1,0,0]=3 61 B11R2.10 BrB1OC2=CC=CC=C2O1 CS-0359105 [1,0,0,0,1,0|2,0,0]=4