0 B13R2.369 CC1=C(N)C=C2N=CC=CC2=C1 C72193 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.369 CC1=NC2=CC=CC=C2C=C1Br P17804 [0,0,0,0,0,0|2,0,1]=3 2 B12R2.24 BrC1=NC2=CN=CC=C2C=C1 F30772 [1,0,0,0,0,0|2,0,1]=4 3 B12R2.24 FC1=CC2=CC=CC=C2C=N1 D82691 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.24 IC1=CC2=CC=NC=C2C=C1 78444 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.24 IC1=CC2=NC=CC=C2N=C1 Y10070 [1,0,0,0,0,0|2,0,1]=4 6 B12R2.24 NC1=CC2=CC=NC=C2N=C1 C11437 [1,0,0,0,0,0|2,0,1]=4 7 B12R2.24 NC1=NC2=CC=NC=C2C=C1 80663 [1,0,0,0,0,0|2,0,1]=4 8 B12R2.24 O=C1CCC2=C(C=CC=N2)N1 66147 [1,0,0,0,0,0|1,0,2]=4 9 B12R2.24 OC1=CC2=CN=CC=C2C=N1 F13344 [1,0,0,0,0,0|3,0,0]=4 10 B14R2.1128 O=CC1=NC2=CC=CC=C2N=C1Cl C75311 [0,1,0,0,0,0|2,0,1]=4 11 B14R2.8188 N[C@H]1CC2=C(C=CC=C2)N(O)C1=O D86144 [0,1,0,0,0,0|1,0,2]=4 12 B14R2.8239 N[C@H]1CC2=C(C=C(Cl)C=C2)NC1=O F12663 [0,1,0,0,0,0|1,0,2]=4 13 B14R2.28472 O=C1NC2=C(Br)C=CC=C2C=C1F D72313 [0,1,0,0,0,0|1,0,0]=2 14 B14R2.741 CN1N=CC2=C(C=CC=C2)CC1=O C12631 [0,0,0,0,0,1|3,0,0]=4 15 B11R1.86 NC1=CC=CN=C1CC(=O)O D96389 [1,0,1,0,0,0|1,0,1]=4 16 B11R1.1 O=C\C=C\C1=CC=C(O)C=C1 O10873 [1,0,1,0,0,0|2,0,0]=4 17 B13R2.32 FC1=C(I)C2=CC=CC=C2N=C1 79247 [1,1,0,0,0,0|1,0,1]=4 18 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=C1 F13243 [1,1,0,0,0,0|2,0,0]=4 19 B13R2.32 OC1=C(Br)C2=CN=CC=C2C=C1 97593 [1,1,0,0,0,0|2,0,0]=4 20 B13R2.32 OC1=C(Cl)C2=CC=CN=C2C=C1 22957 [1,1,0,0,0,0|2,0,0]=4 21 B13R2.57 OCC1=CC2=CN=CC=C2C=C1 26660 [1,1,0,0,0,0|2,0,0]=4 22 B13R2.155 FC1=CC=C2C=CC(Br)=CC2=N1 91505 [1,1,0,0,0,0|1,0,1]=4 23 B13R2.155 FC1=CN=C2C=CC(Br)=CC2=C1 80402 [1,1,0,0,0,0|1,0,1]=4 24 B13R2.155 OC1=CC=C2C=CC(F)=CC2=C1 N14580 [1,1,0,0,0,0|1,0,0]=3 25 B13R2.162 CC1=CC2=C(N)C=CC=C2N=C1 E70238 [1,1,0,0,0,0|1,0,1]=4 26 B13R2.162 NC1=C2C=C(O)C=NC2=CC=C1 33255 [1,1,0,0,0,0|0,0,1]=3 27 B13R2.162 NC1=C2N=C(Cl)C=CC2=CC=C1 90852 [1,1,0,0,0,0|1,0,1]=4 28 B13R2.162 NC1=CN=C2C=CC=C(Cl)C2=C1 80360 [1,1,0,0,0,0|1,0,1]=4 29 B13R2.328 ClC1=CC(Br)=CC2=CC=CC=C12 A10654 [1,1,0,0,0,0|2,0,0]=4 30 B13R2.328 NC1=CC(Br)=CC2=CC=CC=C12 W17912 [1,1,0,0,0,0|2,0,0]=4 31 B13R2.328 NC1=CC(O)=CC2=CC=CC=C12 D97229 [1,1,0,0,0,0|1,0,0]=3 32 B13R2.328 O=C1C=C(Br)C2=C(C=CC=C2)O1 E70006 [1,1,0,0,0,0|1,0,0]=3 33 B13R2.328 O=C1C=C(Cl)C2=C(N=CC=C2)N1 C75777 [1,1,0,0,0,0|1,0,0]=3 34 B13R2.328 O=C1NC2=C(C=CC=N2)C(=O)O1 AT20002 [1,1,0,0,0,0|2,0,0]=4 35 B13R2.3683 BrC1=CC=C2C=C(I)C=NC2=C1 80428 [1,1,0,0,0,0|1,0,1]=4 36 B13R2.3683 CC1=CN=C2C=C(Br)C=CC2=C1 K10052 [1,1,0,0,0,0|1,0,1]=4 37 B13R2.3683 CC1=CN=C2C=C(O)C=CC2=C1 92262 [1,1,0,0,0,0|1,0,1]=4 38 B13R2.3683 FC1=CC=C2C=C(Br)C=CC2=N1 55503 [1,1,0,0,0,0|1,0,1]=4 39 B13R2.3683 FC1=CC=C2C=C(Br)C=NC2=C1 80433 [1,1,0,0,0,0|1,0,1]=4 40 B13R2.3683 FC1=CC=C2C=C(I)C=NC2=C1 80434 [1,1,0,0,0,0|1,0,1]=4 41 B13R2.3683 FC1=CN=C2C=C(Br)C=CC2=C1 82813 [1,1,0,0,0,0|1,0,1]=4 42 B13R2.3683 NC1=CC=C2C=C(F)C=NC2=C1 21015 [1,1,0,0,0,0|1,0,1]=4 43 B13R2.3683 O=C1C=CC2=CC(Cl)=NC=C2N1 78948 [1,1,0,0,0,0|1,0,0]=3 44 B13R2.3683 OC1=CC=C2C=C(Cl)N=CC2=C1 79088 [1,1,0,0,0,0|2,0,0]=4 45 B13R2.5179 BrC1=CC=C2C(I)=CC=CC2=C1 AT10842 [1,1,0,0,0,0|2,0,0]=4 46 B13R2.5179 CC1=CC=C2C(O)=CC=CC2=C1 53842 [1,1,0,0,0,0|2,0,0]=4 47 B13R2.5179 ClC1=C2C=CC(Br)=NC2=CC=C1 D71280 [1,1,0,0,0,0|1,0,1]=4 48 B13R2.5179 NC1=C2C=CC(Br)=CC2=CC=C1 F53484 [1,1,0,0,0,0|2,0,0]=4 49 B13R2.5179 NC1=C2N=CC(O)=CC2=CC=C1 73653 [1,1,0,0,0,0|0,0,1]=3 50 B13R2.5179 OC1=CC=C2C(Br)=CC=NC2=C1 D87193 [1,1,0,0,0,0|2,0,0]=4 51 B13R2.5179 OC1=CC=C2C(Br)=CN=CC2=C1 K10068 [1,1,0,0,0,0|2,0,0]=4 52 B13R2.5179 OC1=CC=C2C(Cl)=CC=CC2=C1 N14583 [1,1,0,0,0,0|1,0,0]=3 53 B13R2.5179 OC1=CC=C2C(Cl)=CN=CC2=C1 K10075 [1,1,0,0,0,0|2,0,0]=4 54 B13R2.3028 CN1C(=O)NC2=C1C=C(Br)C=C2 79273 [0,1,0,0,1,0|2,0,0]=4 55 B15R2.9032 OC1=C(Cl)C2=CC=CC=C2C(Cl)=C1Cl Y10791 [0,2,0,0,0,0|2,0,0]=4 56 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)O1 D74564 [0,0,1,1,0,0|2,0,0]=4 57 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)O1 20909 [0,0,1,1,0,0|2,0,0]=4 58 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 D78838 [0,0,1,0,1,0|1,0,1]=4 59 B11R2.1 NC1=CNC2=C1C=NC=C2 AC3430 [1,0,0,0,1,0|2,0,0]=4 60 B11R2.10 BrC1=CC2=C(C=CN=C2)N1 D84807 [1,0,0,0,1,0|2,0,0]=4 61 B11R2.36 O=C1C=CC2=C(NC=N2)N1 C74457 [1,0,0,0,1,0|2,0,0]=4