0 B13R2.1613 BrCC1=CC=CC2=CC=CC=C21 AC-5792 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.1613 C(=O)C1=CN=CC2=CC=CC=C21 AC-2842 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.1613 COC1=CC=CC2=CC=CC=C21 AC-23677 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.1613 ClCC1=CC=CC2=CC=CC=C21 AC-5784 [0,0,0,0,0,0|4,0,0]=4 4 B13R2.1613 N#CC1=C2C=CC=CC2=CN=C1 AC-7690 [0,0,0,0,0,0|2,0,1]=3 5 B13R2.1613 N#CC1=CC=CC2=CC=CC=C12 AC-5793 [0,0,0,0,0,0|3,0,1]=4 6 B13R2.1613 NCC1=CC=CC2=CC=CC=C21 AC-13039 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.1613 NNC1=NN=CC2=CC=CC=C21 AC-18050 [0,0,0,0,0,0|0,0,0]=0 8 B13R2.1613 O=CC1=C2C=CC=CC2=CC=N1 AC-29675 [0,0,0,0,0,0|3,0,0]=3 9 B13R2.1613 O=CC1=CC=CC2=CC=CC=C12 AC-5796 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.1613 OCC1=C2C=CC=CC2=CC=C1 AC-5790 [0,0,0,0,0,0|4,0,0]=4 11 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 AC-2847 [1,0,0,0,0,0|2,0,0]=3 12 B12R2.1081 BrC1=NC=CC2=CC=CC=C21 AC-1444 [1,0,0,0,0,0|2,0,0]=3 13 B12R2.1081 ClC1=C2C=CC=CC2=NN=C1 AC-27097 [1,0,0,0,0,0|3,0,0]=4 14 B12R2.1081 ClC1=CN=CC2=CC=CC=C12 AC-23135 [1,0,0,0,0,0|2,0,0]=3 15 B12R2.1081 ClC1=NC=CC2=CC=CC=C21 AC-23203 [1,0,0,0,0,0|2,0,0]=3 16 B12R2.1081 ClC1=NC=NC2=CC=CC=C21 AC-2571 [1,0,0,0,0,0|3,0,0]=4 17 B12R2.1081 FC1=CC=CC2=CC=CC=C12 AC-31039 [1,0,0,0,0,0|3,0,0]=4 18 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 AC-9148 [1,0,0,0,0,0|2,0,0]=3 19 B12R2.1081 NC1=C2C=CN=CC2=CC=C1 AC-7303 [1,0,0,0,0,0|3,0,0]=4 20 B12R2.1081 NC1=CC=CC2=C1N=CC=C2 AC-10209 [1,0,0,0,0,0|3,0,0]=4 21 B12R2.1081 NC1=CC=CC2=CC=CC=C12 AC-10635 [1,0,0,0,0,0|2,0,0]=3 22 B12R2.1081 NC1=CC=CC2=CC=NC=C12 AC-9389 [1,0,0,0,0,0|3,0,0]=4 23 B12R2.1081 NC1=CC=CC2=NC=CC=C12 AC-2879 [1,0,0,0,0,0|3,0,0]=4 24 B12R2.1081 NC1=CC=NC2=CC=CC=C12 AC-1256 [1,0,0,0,0,0|3,0,0]=4 25 B12R2.1081 NC1=CN=CC2=CC=CC=C12 AC-24179 [1,0,0,0,0,0|1,0,0]=2 26 B12R2.1081 NC1=CN=NC2=CC=CC=C12 AC-27098 [1,0,0,0,0,0|2,0,0]=3 27 B12R2.1081 NC1=NC=CC2=C1N=CC=C2 AC-26740 [1,0,0,0,0,0|2,0,0]=3 28 B12R2.1081 O=C1C=NNC2=CC=CC=C12 AC-27099 [1,0,0,0,0,0|3,0,0]=4 29 B12R2.1081 OC1=NC=CC2=CC=CC=C21 AC-3150 [1,0,0,0,0,0|2,0,0]=3 30 B12R2.1081 OC1=NC=NC2=CC=CC=C21 AC-2419 [1,0,0,0,0,0|3,0,0]=4 31 B14R2.7150 CNCC1=CC=CC2=CC=CC=C21 AC-2115 [0,1,0,0,0,0|3,0,0]=4 32 B14R2.7150 CNCC1=CC=CC2=CC=CC=C21 AC-5794 [0,1,0,0,0,0|3,0,0]=4 33 B14R2.7150 NCCC1=CC=CC2=CC=CC=C21 AC-29728 [0,1,0,0,0,0|3,0,0]=4 34 B14R2.31359 CC(=O)C1=C2C=CC=CC2=CC=N1 AC-29674 [0,1,0,0,0,0|3,0,0]=4 35 B14R2.31359 C[C@@H](N)C1=CC=CC2=CC=CC=C21 AC-6137 [0,1,0,0,0,0|3,0,0]=4 36 B14R2.31359 C[C@H](N)C1=CC=CC2=CC=CC=C21 AC-6138 [0,1,0,0,0,0|3,0,0]=4 37 B14R2.31359 O=C(O)C1=CN=CC2=CC=CC=C21 AC-7675 [0,1,0,0,0,0|3,0,0]=4 38 B14R2.31359 O=C(O)C1=NC=CC2=CC=CC=C21 AC-10287 [0,1,0,0,0,0|3,0,0]=4 39 B14R2.31359 O=[N+]([O-])C1=CN=CC2=CC=CC=C21 AC-31229 [0,1,0,0,0,0|2,0,1]=4 40 B14R2.31359 OB(O)C1=C2C=CC=CC2=CN=C1 AC-28131 [0,1,0,0,0,0|3,0,0]=4 41 B12R1.77 CCC1=C(C(=O)NN)C=CC=C1 AC-7807 [0,0,1,0,0,0|2,0,1]=4 42 B12R2.1 BrCC1=NOC2=CC=CC=C21 AC-178 [0,0,0,0,1,0|3,0,0]=4 43 B12R2.1 N#CC1=NNC2=C1C=CC=C2 AC-27141 [0,0,0,0,1,0|1,0,2]=4 44 B12R2.1 NCC1=CNC2=C1C=CC=C2 AC-29759 [0,0,0,0,1,0|2,0,1]=4 45 B12R2.1 O=CC1=NNC2=CC=CC=C21 AC-8942 [0,0,0,0,1,0|2,0,1]=4 46 B12R2.1 O=CN1N=NC2=CC=CC=C21 AC-27565 [0,0,0,0,1,0|3,0,0]=4 47 B12R2.1 OCC1=NNC2=CC=CC=C21 AC-25003 [0,0,0,0,1,0|2,0,1]=4 48 B11R2.20 C1=CC2=CN=CC=C2N=C1 AC-7911 [2,0,0,0,0,0|2,0,0]=4 49 B11R2.20 C1=CC=C2N=CN=CC2=C1 AC-18352 [2,0,0,0,0,0|2,0,0]=4 50 B13R2.32 BrC1=NC=C2C=CC=CC2=C1Br AC-28298 [1,1,0,0,0,0|2,0,0]=4 51 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=N1 AC-28299 [1,1,0,0,0,0|2,0,0]=4 52 B13R2.32 NC1=C(Br)C=CC2=CC=CC=C21 AC-27919 [1,1,0,0,0,0|2,0,0]=4 53 B13R2.32 NC1=C2C=CC=CC2=CC=C1O AC-10612 [1,1,0,0,0,0|2,0,0]=4 54 B13R2.32 OC1=C(Br)C2=CC=CC=C2C=N1 AC-28295 [1,1,0,0,0,0|2,0,0]=4 55 B13R2.162 CC1=CC=C2C=CN=C(Cl)C2=C1 AC-7093 [1,1,0,0,0,0|2,0,0]=4 56 B13R2.162 ClC1=CC=C2C=CN=C(Cl)C2=C1 AC-23259 [1,1,0,0,0,0|2,0,0]=4 57 B13R2.162 NC1=CC=CC2=CC=C(O)C=C12 AC-12352 [1,1,0,0,0,0|2,0,0]=4 58 B13R2.162 OC1=C2C=C(Br)C=CC2=CN=C1 AC-30491 [1,1,0,0,0,0|2,0,0]=4 59 B13R2.162 OC1=NC=CC2=CC=C(Cl)C=C21 AC-28291 [1,1,0,0,0,0|2,0,0]=4 60 B13R2.328 BrC1=NC(Br)=C2C=CC=CC2=C1 AC-28580 [1,1,0,0,0,0|2,0,0]=4 61 B13R2.328 ClC1=NC(Cl)=C2C=CC=CC2=C1 AC-7548 [1,1,0,0,0,0|2,0,0]=4 62 B13R2.342 NC1=CC=CC2=C(N)C=CC=C12 AC-8269 [1,1,0,0,0,0|2,0,0]=4 63 B13R2.342 NC1=CC=CC2=C(O)C=CC=C12 AC-12346 [1,1,0,0,0,0|2,0,0]=4 64 B13R2.342 NC1=CC=CC2=C1C=CC=C2Br AC-29762 [1,1,0,0,0,0|2,0,0]=4 65 B13R2.342 NC1=CC=CC2=C1C=CN=C2Cl AC-31857 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.342 OC1=NC=CC2=C(O)C=CC=C12 AC-10035 [1,1,0,0,0,0|2,0,0]=4 67 B13R2.371 ClC1=CN=C(Cl)C2=CC=CC=C12 AC-23194 [1,1,0,0,0,0|2,0,0]=4 68 B13R2.371 ClC1=NC=C(Br)C2=CC=CC=C21 AC-7098 [1,1,0,0,0,0|2,0,0]=4 69 B13R2.371 ClC1=NN=C(Cl)C2=CC=CC=C21 AC-5102 [1,1,0,0,0,0|1,0,0]=3 70 B13R2.371 NC1=C2C=CC=CC2=C(Cl)C=C1 AC-27712 [1,1,0,0,0,0|2,0,0]=4 71 B13R2.371 NC1=CC=C(Br)C2=CC=CC=C12 AC-2692 [1,1,0,0,0,0|2,0,0]=4 72 B13R2.371 NC1=CC=C(O)C2=C1C=CC=C2 AC-29204 [1,1,0,0,0,0|2,0,0]=4 73 B13R2.371 O=C1NN=C(Cl)C2=C1C=CC=C2 AC-36706 [1,1,0,0,0,0|1,0,1]=4 74 B13R2.371 OC1=C2C=CC=CC2=C(Br)C=N1 AC-28290 [1,1,0,0,0,0|2,0,0]=4 75 B13R2.371 OC1=CN=C(Cl)C2=CC=CC=C12 AC-23146 [1,1,0,0,0,0|2,0,0]=4 76 B13R2.4818 NC1=CC=CC2=CC=CC(N)=C12 AC-11649 [1,1,0,0,0,0|2,0,0]=4 77 B13R2.5179 ClC1=C2C=CC(Br)=CC2=CC=N1 AC-7723 [1,1,0,0,0,0|2,0,0]=4 78 B13R2.5179 O=C1NN=CC2=CC(Br)=CC=C12 AC-9505 [1,1,0,0,0,0|1,0,1]=4 79 B13R2.72 NC(=O)C1=NNC2=C1C=CC=C2 AC-27142 [0,1,0,0,1,0|1,0,1]=4 80 B13R2.18 BrC1=C(C2=NN=NN2)C=CC=C1 AC-1082 [0,0,1,1,0,0|1,0,1]=4 81 B11R2.1 BrC1=NNC2=CC=CC=C21 AC-1280 [1,0,0,0,1,0|1,0,1]=4 82 B11R2.1 CN1N=NC2=CC=CC=C21 AC-24250 [1,0,0,0,1,0|2,0,0]=4 83 B11R2.1 ClC1=NOC2=CC=CC=C21 AC-26526 [1,0,0,0,1,0|2,0,0]=4 84 B11R2.1 ClC1=NSC2=C1C=CC=C2 AC-224 [1,0,0,0,1,0|2,0,0]=4 85 B11R2.1 IC1=NNC2=CC=CC=C21 AC-12962 [1,0,0,0,1,0|1,0,1]=4 86 B11R2.1 NC1=NNC2=C1N=CC=C2 AC-30737 [1,0,0,0,1,0|1,0,1]=4 87 B11R2.1 NC1=NNC2=NC=CC=C12 AC-24355 [1,0,0,0,1,0|1,0,1]=4 88 B11R2.1 NC1=NSC2=C1C=CC=C2 AC-5045 [1,0,0,0,1,0|1,0,0]=3 89 B11R2.1 OC1=NOC2=CC=CC=C21 AC-26513 [1,0,0,0,1,0|2,0,0]=4 90 B11R2.1 ON1N=NC2=CC=CC=C21 AC-2558 [1,0,0,0,1,0|2,0,0]=4 91 B11R2.1 ON1N=NC2=CC=CC=C21 AC-493 [1,0,0,0,1,0|2,0,0]=4