0 B13R2.1613 ClCC1=CC=CC2=CC=CC=C21 2083808 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.1613 N#CC1=CC=CC2=CC=CC=C12 1507829 [0,0,0,0,0,0|3,0,1]=4 2 B13R2.1613 NNC1=NC=NC2=CC=CC=C21 7010010204 [0,0,0,0,0,0|2,0,0]=2 3 B13R2.1613 O=CC1=CC=CC2=CC=CC=C12 2083827 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 4005684 [1,0,0,0,0,0|2,0,0]=3 5 B12R2.1081 ClC1=C2C=CC=CC2=NC=N1 2833074 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.1081 ClC1=C2C=CN=CC2=CC=N1 5730887 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 2212834 [1,0,0,0,0,0|2,0,0]=3 8 B12R2.1081 NC1=CC=CC2=CC=CC=C12 1507828 [1,0,0,0,0,0|2,0,0]=3 9 B12R2.1081 NC1=CC=CC2=CC=CN=C12 1232989 [1,0,0,0,0,0|3,0,0]=4 10 B12R2.1081 NC1=NC=CC2=CC=CC=C21 1055516 [1,0,0,0,0,0|1,0,0]=2 11 B12R2.1081 O=C1C=NNC2=CC=CC=C12 7020542795 [1,0,0,0,0,0|3,0,0]=4 12 B12R2.1081 O=C1NC=CC2=CC=CC=C12 1522001 [1,0,0,0,0,0|2,0,1]=4 13 B12R2.1081 O=C1NN=CC2=C1C=CC=C2 3463424 [1,0,0,0,0,0|1,0,1]=3 14 B12R2.1081 O=C1NN=NC2=CC=CC=C12 7015160142 [1,0,0,0,0,0|2,0,1]=4 15 B12R2.1081 OC1=CC=CC2=CC=CC=C12 1507830 [1,0,0,0,0,0|3,0,0]=4 16 B14R2.203 CC1=C(C#N)C2=C(C=CC=C2)C=N1 4401439 [0,1,0,0,0,0|2,0,1]=4 17 B14R2.1146 CNC1=NC(Cl)=NC2=CC=CC=C21 7020700362 [0,1,0,0,0,0|3,0,0]=4 18 B14R2.1146 NNC1=CC(=O)OC2=C1C=CC=C2 7110952632 [0,1,0,0,0,0|3,0,0]=4 19 B14R2.7150 CNCC1=C2C=CC=CC2=CC=C1 2992588 [0,1,0,0,0,0|3,0,0]=4 20 B14R2.11684 CNC1=NC=NC2=CC=C(Br)C=C21 1739603 [0,1,0,0,0,0|3,0,0]=4 21 B14R2.11684 N#CC1=NC=CC2=C1C=C(Cl)C=C2 4379558 [0,1,0,0,0,0|2,0,1]=4 22 B14R2.11684 NNC1=NC=NC2=CC=C(Br)C=C21 7010010105 [0,1,0,0,0,0|2,0,0]=3 23 B14R2.31359 CN(C)C1=CN=CC2=CC=CC=C21 9958098 [0,1,0,0,0,0|2,0,0]=3 24 B14R2.31359 NC(=O)C1=CN=CC2=C1C=CC=C2 4388583 [0,1,0,0,0,0|2,0,0]=3 25 B14R2.31359 NC(=S)C1=C2C=CC=CC2=CC=C1 7020331326 [0,1,0,0,0,0|3,0,0]=4 26 B14R2.31359 O=C(O)C1=C2C=CC=CC2=CC=N1 2836564 [0,1,0,0,0,0|3,0,0]=4 27 B12R1.77 COC1=CC=CC=C1C(=O)NN 7117190031 [0,0,1,0,0,0|3,0,0]=4 28 B12R2.1 NCC1=CNC2=CC=CC=C12 7020690230 [0,0,0,0,1,0|2,0,1]=4 29 B12R2.1 NCC1=NC=C2C=CC=CN21 1143980 [0,0,0,0,1,0|2,0,0]=3 30 B12R2.1 NCC1=NN=C2C=CC=CN21 1056738 [0,0,0,0,1,0|2,0,0]=3 31 B12R2.1 NCC1=NN=C2C=CC=CN21 7010458 [0,0,0,0,1,0|2,0,0]=3 32 B12R2.1 OCN1N=CC2=C1C=CC=C2 11639076 [0,0,0,0,1,0|3,0,0]=4 33 B11R1.16 N#C\N=C(/N)C1=CC=CC=C1 5010119 [1,0,1,0,0,0|2,0,0]=4 34 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 2829096 [1,0,1,0,0,0|1,0,1]=4 35 B11R1.222 NNC(=O)C1=CC=CC=C1Br 7119846925 [1,0,1,0,0,0|2,0,0]=4 36 B11R1.222 NNC(=O)C1=CC=CC=C1F 7119846922 [1,0,1,0,0,0|2,0,0]=4 37 B11R1.222 NNC(=O)C1=CC=CC=C1N 974743 [1,0,1,0,0,0|1,0,1]=4 38 B11R2.20 C1=CC=C2C=CC=CC2=C1 2826500 [2,0,0,0,0,0|2,0,0]=4 39 B11R2.20 C1=CC=C2C=NC=CC2=C1 2826576 [2,0,0,0,0,0|1,0,0]=3 40 B13R1.718 CN\C(S)=N\N=C/C1=CC=CN=C1 7511160039 [0,1,1,0,0,0|2,0,0]=4 41 B13R2.162 CC1=CC=C2N=CN=C(N)C2=C1 0109790051 [1,1,0,0,0,0|2,0,0]=4 42 B13R2.342 NC1=C2C=CC=C(O)C2=CC=C1 2831464 [1,1,0,0,0,0|2,0,0]=4 43 B13R2.371 CC1=CC=C(N)C2=CC=CC=C12 1507923 [1,1,0,0,0,0|2,0,0]=4 44 B13R2.371 NC1=C2C=CC=CC2=C(N)N=N1 0111070321 [1,1,0,0,0,0|0,0,0]=2 45 B13R2.4818 CC1=CN=CC2=C1C(Br)=CC=C2 4383043 [1,1,0,0,0,0|2,0,0]=4 46 B13R2.5179 OC1=CN=CC2=C1C=CC(Cl)=C2 4401431 [1,1,0,0,0,0|2,0,0]=4 47 B13R2.1 NCCC1=NC=C2C=CC=CN21 1143981 [0,1,0,0,1,0|2,0,0]=4 48 B13R2.1 NCCC1=NC=C2C=CC=CN21 12712370 [0,1,0,0,1,0|2,0,0]=4 49 B13R2.1 NCCC1=NN=C2C=CC=CN21 15298250 [0,1,0,0,1,0|2,0,0]=4 50 B13R2.1 NCCC1=NN=C2C=CC=CN21 4434660 [0,1,0,0,1,0|2,0,0]=4 51 B13R2.72 CC(N)C1=NN=C2C=CC=CN21 15298281 [0,1,0,0,1,0|2,0,0]=4 52 B15R2.68122 NC(=S)NC1=CC=CC2=CC=CC=C21 1321535 [0,2,0,0,0,0|2,0,0]=4 53 B13R2.3085 NN1C(=O)C2=C(C=CC=C2)C1=O 2832543 [0,0,1,1,0,0|2,0,0]=4 54 B13R2.18 CC1=C(C2=NN=NN2)C=CC=C1 1779691 [0,0,1,1,0,0|0,0,2]=4 55 B11R2.1 BrC1=NNC2=C1C=CC=C2 0111070064 [1,0,0,0,1,0|1,0,1]=4 56 B11R2.1 NC1=C2C=CC=CC2=NS1 7110952728 [1,0,0,0,1,0|1,0,0]=3 57 B11R2.1 NC1=NNC2=C1C=CC=C2 1218431 [1,0,0,0,1,0|0,0,1]=3 58 B11R2.1 NC1=NNC2=NC=CC=C12 7110952567 [1,0,0,0,1,0|1,0,1]=4 59 B11R2.1 OC1=NNC2=CC=CC=C21 7020542804 [1,0,0,0,1,0|1,0,1]=4 60 B11R2.1 OC1=NOC2=CC=CC=C21 5011377 [1,0,0,0,1,0|2,0,0]=4 61 B11R2.1 ON1N=NC2=CC=CC=C21 1194818 [1,0,0,0,1,0|2,0,0]=4 62 B11R2.1 ON1N=NC2=CC=CC=C21 22430535 [1,0,0,0,1,0|2,0,0]=4 63 B11R2.1 SC1=NN=C2C=CC=CN12 1056737 [1,0,0,0,1,0|2,0,0]=4