0 B13R2.328 FC1=CC(I)=CC2=CC=CC=C12 102038 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.328 NC1=CC(=O)OC2=CC=CC=C12 18942 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)O1 20203 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.328 O=C1CC2=CC=CC=C2C(=O)N1 14932 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.328 O=C1CC2=CC=CC=C2C(=O)O1 16347 [0,0,0,0,0,0|4,0,0]=4 5 B13R2.328 O=C1CC2=CC=CC=C2C(=S)N1 15841 [0,0,0,0,0,0|3,0,1]=4 6 B13R2.328 O=C1NC(=O)C2=CC=CC=C2N1 20124 [0,0,0,0,0,0|2,0,2]=4 7 B12R2.24 CC1=CC2=CC=CC=C2C=N1 16471 [1,0,0,0,0,0|2,0,0]=3 8 B12R2.24 O=C1C=CC2=CC=CC=C2N1 101464 [1,0,0,0,0,0|2,0,1]=4 9 B12R2.1081 O=C1C=CCC2=CC=CC=C12 18244 [1,0,0,0,0,0|3,0,0]=4 10 B12R2.1081 O=C1C=CNC2=CC=CC=C12 101470 [1,0,0,0,0,0|2,0,1]=4 11 B14R2.1146 CNC1=CC(=O)OC2=CC=CC=C12 18943 [0,1,0,0,0,0|3,0,0]=4 12 B14R2.8045 CC1=C2N=C(Cl)C=C(Cl)C2=CC=C1 9586 [0,1,0,0,0,0|3,0,0]=4 13 B14R2.8045 CC1=C2N=C(S)C=C(S)C2=CC=C1 9587 [0,1,0,0,0,0|3,0,0]=4 14 B14R2.8188 ClC1=NC2=CC=CC=C2C(Cl)=C1I 100717 [0,1,0,0,0,0|3,0,0]=4 15 B14R2.8235 CC1=CC2=C(C=C1)N=C(O)C=C2C 20143 [0,1,0,0,0,0|3,0,0]=4 16 B14R2.8235 CC1=CC=C2N=C(Cl)C=C(Cl)C2=C1 19009 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.107 C\C(N)=C\C(=O)C1=CC=CC=C1 13294 [0,0,1,0,0,0|3,0,0]=4 18 B12R2.18 C=C1C(=O)NC2=CC=CC=C12 18545 [0,0,0,0,1,0|2,0,1]=4 19 B12R2.18 CC1=C(C)C2=CC=CC=C2C1 16651 [0,0,0,0,1,0|3,0,0]=4 20 B12R2.18 CC1=C(C)C2=CC=CC=C2N1 16046 [0,0,0,0,1,0|2,0,1]=4 21 B12R2.18 O=C1NC2=CC=CC=C2C1=O 20896 [0,0,0,0,1,0|2,0,1]=4 22 B12R2.2028 O=C1OC(=O)C2=CC=CC=C12 13758 [0,0,0,0,1,0|3,0,0]=4 23 B12R2.2028 O=C1SC(=O)C2=CC=CC=C12 836 [0,0,0,0,1,0|3,0,0]=4 24 B14R2.738 CC1=NC2=C(C=CC=C2)N=C(C)C1 17674 [0,0,0,0,0,1|3,0,0]=4 25 B11R2.20 C1=CC=C2C=NC=CC2=C1 101921 [2,0,0,0,0,0|1,0,0]=3 26 B11R2.20 C1=CC=C2N=CC=CC2=C1 101934 [2,0,0,0,0,0|1,0,0]=3 27 B13R2.162 ClC1=NC2=C(Br)C=CC=C2C=C1 102068 [1,1,0,0,0,0|2,0,0]=4 28 B13R2.369 FC1=CC2=CC=CC=C2N=C1Br 101673 [1,1,0,0,0,0|2,0,0]=4 29 B13R2.3683 BrC1=CC=C2N=C(Br)C=CC2=C1 101288 [1,1,0,0,0,0|2,0,0]=4 30 B13R2.3683 ClC1=NC2=CC=C(Br)C=C2C=C1 101286 [1,1,0,0,0,0|2,0,0]=4 31 B13R2.3683 NC1=CC=C2C=C(N)C=CC2=C1 10795 [1,1,0,0,0,0|2,0,0]=4 32 B13R2.3683 NC1=CC=C2C=C(O)C=CC2=C1 10794 [1,1,0,0,0,0|2,0,0]=4 33 B13R2.342 NC1=CC=CC2=C(N)C=CC=C12 10890 [1,1,0,0,0,0|2,0,0]=4 34 B15R2.21329 COC1=CC=C2N=C(N)N=[N+]([O-])C2=C1 19579 [0,2,0,0,0,0|2,0,0]=4 35 B13R2.10 NC1=NN=C(C2=CC=CC=C2)O1 10263 [0,0,1,1,0,0|1,0,1]=4 36 B13R2.10 NC1=NN=C(C2=CC=CC=C2)S1 21464 [0,0,1,1,0,0|1,0,1]=4 37 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 19771 [0,0,1,0,1,0|1,0,1]=4 38 B11R2.10 CC1=NC2=CC=CC=C2N1 11720 [1,0,0,0,1,0|1,0,1]=4 39 B11R2.10 NC1=NC2=CC=CC=C2N1 500 [1,0,0,0,1,0|0,0,1]=3 40 B11R2.10 SC1=NC2=C(C=CC=C2)N1 520 [1,0,0,0,1,0|1,0,1]=4 41 B11R2.10 SC1=NC2=CC=CC=C2O1 10015 [1,0,0,0,1,0|2,0,0]=4 42 B11R2.106 N1N=CC2=C1N=CN=C2N 20623 [1,0,0,0,1,0|2,0,0]=4 43 B11R2.54 O=C1C(=O)C2=CC=CC=C12 16264 [0,0,0,0,2,0|2,0,0]=4 44 B13R1.45 NC(=O)NN=C(O)C1=CC=CC=C1 12255 [0,0,1,0,0,1|2,0,0]=4