0 B13R2.1613 BrCC1=CC=CC2=C1C=CC=C2 SC-03380 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.1613 BrCC1=CN=CC2=C1C=CC=C2 SC-13186 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.1613 BrCC1=NC=CC2=CC=CC=C21 SC-58602 [0,0,0,0,0,0|3,0,0]=3 3 B13R2.1613 CNC1=C2C=CC=CC2=CC=C1 SC-20884 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.1613 ClCC1=CC=CC2=CC=CC=C21 SC-46766 [0,0,0,0,0,0|4,0,0]=4 5 B13R2.1613 N#CC1=C2C=CC=CC2=NN=C1 SC-87725 [0,0,0,0,0,0|3,0,1]=4 6 B13R2.1613 N#CC1=NC=CC2=CC=CC=C21 SC-54250 [0,0,0,0,0,0|2,0,1]=3 7 B13R2.1613 NCC1=C2C=CC=CC2=CC=C1 SC-98299 [0,0,0,0,0,0|3,0,0]=3 8 B13R2.1613 NCC1=C2C=CC=NC2=CC=C1 SC-42463 [0,0,0,0,0,0|4,0,0]=4 9 B13R2.1613 NCC1=C2N=CC=CC2=CC=C1 SC-42702 [0,0,0,0,0,0|4,0,0]=4 10 B13R2.1613 NCC1=CC=NC2=CC=CC=C12 SC-12398 [0,0,0,0,0,0|4,0,0]=4 11 B13R2.1613 NCC1=CC=NC2=CC=CC=C12 SC-A3648 [0,0,0,0,0,0|4,0,0]=4 12 B13R2.1613 NCC1=CN=CC2=C1C=CC=C2 SC-41115 [0,0,0,0,0,0|2,0,0]=2 13 B13R2.1613 NCC1=NC=CC2=C1C=CC=C2 SC-A2820 [0,0,0,0,0,0|2,0,0]=2 14 B13R2.1613 NNC1=C2C=CC=CC2=CC=C1 SC-59714 [0,0,0,0,0,0|2,0,0]=2 15 B13R2.1613 NNC1=NN=CC2=C1C=CC=C2 SC-16076 [0,0,0,0,0,0|0,0,0]=0 16 B13R2.1613 O=CC1=C2C=CC=CC2=CC=C1 SC-06180 [0,0,0,0,0,0|4,0,0]=4 17 B13R2.1613 O=CC1=NC=CC2=C1C=CC=C2 SC-23511 [0,0,0,0,0,0|3,0,0]=3 18 B13R2.1613 OCC1=CN=CC2=C1C=CC=C2 SC-13170 [0,0,0,0,0,0|3,0,0]=3 19 B12R2.1081 BrC1=C2C=CC=CC2=CC=N1 SC-01317 [1,0,0,0,0,0|2,0,0]=3 20 B12R2.1081 BrC1=C2N=CC=CC2=CN=C1 SC-34679 [1,0,0,0,0,0|3,0,0]=4 21 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 SC-01318 [1,0,0,0,0,0|2,0,0]=3 22 B12R2.1081 ClC1=C2C=CC=CC2=NC=N1 SC-15091 [1,0,0,0,0,0|3,0,0]=4 23 B12R2.1081 ClC1=CN=CC2=C1C=CC=C2 SC-41611 [1,0,0,0,0,0|2,0,0]=3 24 B12R2.1081 ClC1=NC=CC2=C1C=CC=C2 SC-44075 [1,0,0,0,0,0|2,0,0]=3 25 B12R2.1081 FC1=C2C=CC=CC2=CC=C1 SC-13683 [1,0,0,0,0,0|3,0,0]=4 26 B12R2.1081 NC1=C2C=CC=CC2=NN=C1 SC-53133 [1,0,0,0,0,0|2,0,0]=3 27 B12R2.1081 NC1=C2C=CN=CC2=CC=C1 SC-00394 [1,0,0,0,0,0|3,0,0]=4 28 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 SC-05481 [1,0,0,0,0,0|3,0,0]=4 29 B12R2.1081 NC1=C2N=CC=CC2=CC=N1 SC-75912 [1,0,0,0,0,0|2,0,0]=3 30 B12R2.1081 NC1=CC=CC2=NC=CC=C12 SC-05713 [1,0,0,0,0,0|3,0,0]=4 31 B12R2.1081 NC1=CC=NC2=CC=CC=C12 SC-52223 [1,0,0,0,0,0|3,0,0]=4 32 B12R2.1081 NC1=CN=CC2=C1C=CC=C2 SC-47520 [1,0,0,0,0,0|1,0,0]=2 33 B12R2.1081 NC1=NC=CC2=C1C=CN=C2 SC-33650 [1,0,0,0,0,0|2,0,0]=3 34 B12R2.1081 NC1=NC=CC2=CC=CC=C21 SC-25246 [1,0,0,0,0,0|1,0,0]=2 35 B12R2.1081 NC1=NC=NC2=C1C=CC=C2 SC-14968 [1,0,0,0,0,0|2,0,0]=3 36 B12R2.1081 O=C1C=NNC2=CC=CC=C12 SC-31401 [1,0,0,0,0,0|3,0,0]=4 37 B12R2.1081 O=C1NC=CC2=C1C=CC=C2 SC-14557 [1,0,0,0,0,0|2,0,1]=4 38 B12R2.1081 O=C1NC=CC2=CC=CC=C12 SC-04796 [1,0,0,0,0,0|2,0,1]=4 39 B12R2.1081 OC1=C2C=CC=CC2=NN=C1 SC-A2761 [1,0,0,0,0,0|3,0,0]=4 40 B12R2.1081 OC1=CN=CC2=C1C=CC=C2 SC-35208 [1,0,0,0,0,0|2,0,0]=3 41 B14R2.1131 NNC1=C2C=CC=CC2=C(Cl)C=C1 SC-59004 [0,1,0,0,0,0|2,0,0]=3 42 B14R2.7150 NCCC1=C2C=CC=CC2=CC=C1 SC-39790 [0,1,0,0,0,0|3,0,0]=4 43 B14R2.31359 CC(N)C1=CC=CC2=C1C=CC=C2 SC-04460 [0,1,0,0,0,0|3,0,0]=4 44 B14R2.31359 C[C@@H](N)C1=C2C=CC=CC2=CC=C1 SC-04076 [0,1,0,0,0,0|3,0,0]=4 45 B14R2.31359 O=C(O)C1=CN=CC2=CC=CC=C21 SC-14678 [0,1,0,0,0,0|3,0,0]=4 46 B14R2.31359 OB(O)C1=CN=CC2=CC=CC=C21 SC-02086 [0,1,0,0,0,0|3,0,0]=4 47 B14R2.31359 [C@@H](C)(N)C1=CC=CC2=C1C=CC=C2 SC-00175 [0,1,0,0,0,0|3,0,0]=4 48 B12R1.77 COC1=CC=CC=C1C(=N)NO SC-56279 [0,0,1,0,0,0|3,0,0]=4 49 B12R2.1 N#CC1=NNC2=C1C=CC=C2 SC-05320 [0,0,0,0,1,0|1,0,2]=4 50 B12R2.1 NCC1=CNC2=CC=CC=C12 SC-21199 [0,0,0,0,1,0|2,0,1]=4 51 B12R2.1 NCC1=NNC2=C1C=CC=C2 SC-00723 [0,0,0,0,1,0|1,0,1]=3 52 B12R2.1 OCN1N=NC2=CC=CC=C21 SC-97641 [0,0,0,0,1,0|3,0,0]=4 53 B11R1.222 NNC(=O)C1=CC=CC=C1F SC-62263 [1,0,1,0,0,0|2,0,0]=4 54 B11R2.20 C1=CC2=C(C=C1)C=NC=C2 SC-46258 [2,0,0,0,0,0|1,0,0]=3 55 B11R2.20 C1=CC2=C(C=C1)C=NN=C2 SC-27128 [2,0,0,0,0,0|0,0,0]=2 56 B11R2.20 C1=CC2=C(C=C1)CCN=C2 SC-47506 [2,0,0,0,0,0|1,0,1]=4 57 B11R2.20 C1=CC2=C(C=CN=C2)C=N1 SC-48425 [2,0,0,0,0,0|2,0,0]=4 58 B11R2.20 C1=CC2=C(C=NC=C2)N=C1 SC-43704 [2,0,0,0,0,0|2,0,0]=4 59 B11R2.20 C1=CC2=CN=CC=C2N=C1 SC-14182 [2,0,0,0,0,0|2,0,0]=4 60 B13R2.32 NC1=C(Br)C2=C(C=CC=C2)C=N1 SC-82285 [1,1,0,0,0,0|2,0,0]=4 61 B13R2.162 ClC1=NC=CC2=C1C=C(Br)C=C2 SC-25850 [1,1,0,0,0,0|2,0,0]=4 62 B13R2.162 FC1=CC2=C(C=CN=C2Cl)C=C1 SC-91007 [1,1,0,0,0,0|2,0,0]=4 63 B13R2.162 NC1=NC=CC2=C1C=C(Br)C=C2 SC-28051 [1,1,0,0,0,0|1,0,0]=3 64 B13R2.162 OC1=NC=CC2=C1C=C(F)C=C2 SC-33732 [1,1,0,0,0,0|2,0,0]=4 65 B13R2.328 ClC1=CC2=CC=CC=C2C(Cl)=N1 SC-06749 [1,1,0,0,0,0|2,0,0]=4 66 B13R2.328 NC1=C2C=CC=CC2=CC(Br)=C1 SC-A2477 [1,1,0,0,0,0|2,0,0]=4 67 B13R2.328 NC1=CC2=C(C=CC=C2)C(Br)=N1 SC-18853 [1,1,0,0,0,0|2,0,0]=4 68 B13R2.328 NC1=NC(Cl)=NC2=C1C=CC=C2 SC-20627 [1,1,0,0,0,0|2,0,0]=4 69 B13R2.342 NC1=C2C=CC=C(Br)C2=CC=C1 SC-72876 [1,1,0,0,0,0|2,0,0]=4 70 B13R2.342 OC1=NC=CC2=C1C=CC=C2Br SC-32828 [1,1,0,0,0,0|2,0,0]=4 71 B13R2.371 CC1=NC=C(Br)C2=C1C=CC=C2 SC-21484 [1,1,0,0,0,0|2,0,0]=4 72 B13R2.371 ClC1=NN=C(Cl)C2=CC=CC=C21 SC-43785 [1,1,0,0,0,0|1,0,0]=3 73 B13R2.371 NC1=C2C=CC=CC2=C(Br)C=C1 SC-26617 [1,1,0,0,0,0|2,0,0]=4 74 B13R2.371 NC1=C2C=CC=CC2=C(F)C=C1 SC-71142 [1,1,0,0,0,0|2,0,0]=4 75 B13R2.371 NC1=NC=C(Br)C2=CC=CC=C21 SC-34366 [1,1,0,0,0,0|1,0,0]=3 76 B13R2.371 OC1=CN=C(Cl)C2=C1C=CC=C2 SC-65632 [1,1,0,0,0,0|2,0,0]=4 77 B13R2.4818 NC1=CC=CC2=C1C(Br)=CN=C2 SC-93469 [1,1,0,0,0,0|2,0,0]=4 78 B13R2.4818 OC1=NC=CC2=C1C(F)=CC=C2 SC-41123 [1,1,0,0,0,0|2,0,0]=4 79 B13R2.5179 ClC1=NN=CC2=C1C=CC(Br)=C2 SC-25492 [1,1,0,0,0,0|1,0,0]=3 80 B13R2.5179 FC1=CC2=C(C=C1)C(Cl)=NC=C2 SC-34526 [1,1,0,0,0,0|2,0,0]=4 81 B13R2.5179 NC1=CC2=C(C=C1)C(Br)=CN=C2 SC-93368 [1,1,0,0,0,0|2,0,0]=4 82 B13R2.5179 NC1=CC2=C(C=C1)C(O)=NC=C2 SC-83884 [1,1,0,0,0,0|2,0,0]=4 83 B13R2.5179 O=C1NN=CC2=C1C=CC(Br)=C2 SC-27389 [1,1,0,0,0,0|1,0,1]=4 84 B13R2.5179 OC1=CC2=C(C=C1)C(Cl)=NC=C2 SC-60466 [1,1,0,0,0,0|2,0,0]=4 85 B13R2.72 NC(=O)C1=NOC2=CC=CC=C21 SC-47809 [0,1,0,0,1,0|2,0,0]=4 86 B13R2.72 NC(=S)C1=NOC2=CC=CC=C21 SC-47810 [0,1,0,0,1,0|2,0,0]=4 87 B15R2.22222 NNC1=NN=C(NN)C2=CC=CC=C21 SC-16077 [0,2,0,0,0,0|0,0,0]=2 88 B13R2.15 NC1=C(C2=CC=CC=C2)N=NS1 SC-35875 [0,0,1,1,0,0|2,0,0]=4 89 B13R2.18 BrC1=CC=CC=C1C2=NN=NN2 SC-78017 [0,0,1,1,0,0|1,0,1]=4 90 B13R2.18 NC1=CC=CC=C1C2=NN=NN2 SC-99383 [0,0,1,1,0,0|1,0,1]=4 91 B11R2.1 BrC1=C2C=CC=CN2C=N1 SC-97553 [1,0,0,0,1,0|2,0,0]=4 92 B11R2.1 BrC1=NNC2=C1C=CC=C2 SC-22820 [1,0,0,0,1,0|1,0,1]=4 93 B11R2.1 ClN1N=NC2=CC=CC=C21 SC-52390 [1,0,0,0,1,0|2,0,0]=4 94 B11R2.1 NC1=CNC2=C1C=CC=C2 SC-83581 [1,0,0,0,1,0|1,0,1]=4 95 B11R2.1 NC1=CNC2=C1C=CC=C2 SC-A4660 [1,0,0,0,1,0|1,0,1]=4 96 B11R2.1 NC1=NOC2=CC=CC=C21 SC-17146 [1,0,0,0,1,0|1,0,0]=3 97 B11R2.1 NN1C=CC2=C1C=CC=C2 SC-28406 [1,0,0,0,1,0|2,0,0]=4 98 B11R2.1 ON1N=NC2=CC=CC=C21 SC-00635 [1,0,0,0,1,0|2,0,0]=4 99 B11R2.1 ON1N=NC2=CC=CC=C21 SC-11263 [1,0,0,0,1,0|2,0,0]=4 100 B11R2.1 [O-]N1N=NC2=CC=CC=C21 SC-A2192 [1,0,0,0,1,0|2,0,0]=4 101 B11R2.106 NC1=NC=CC2=C1C=CN2 SC-49255 [1,0,0,0,1,0|2,0,0]=4 102 B11R2.106 NC1=NC=CC2=C1NC=C2 SC-50085 [1,0,0,0,1,0|2,0,0]=4