0 B13R2.57 CNc1ncc2ccccc2n1 WXVL_AK00442LP0064 [0,1,0,0,0,0|3,0,0]=4 1 B13R2.57 CNc1ncc2ccccc2n1 WXVL_AK00442LP0064 [0,1,0,0,0,0|3,0,0]=4 2 B11R1.86 CC(=O)Nc1cccnc1Br WXVL_AF0399SB0150 [0,0,1,0,0,0|3,0,0]=4 3 B11R1.86 CC(=O)Nc1cccnc1Br WXVL_AF0399SB0150 [0,0,1,0,0,0|3,0,0]=4 4 B11R1.86 CC(=O)Nc1cccnc1C WXVL_AF0055SB0150 [0,0,1,0,0,0|2,0,1]=4 5 B11R1.86 CC(=O)Nc1cccnc1C WXVL_AF0055SB0150 [0,0,1,0,0,0|2,0,1]=4 6 B11R1.86 CC(=O)Nc1cccnc1Cl WXVL_AF0009SB0150 [0,0,1,0,0,0|3,0,0]=4 7 B11R1.86 CC(=O)Nc1cccnc1Cl WXVL_AF0009SB0150 [0,0,1,0,0,0|3,0,0]=4 8 B11R1.86 CC(=O)Nc1cccnc1F WXVL_AF0419SB0150 [0,0,1,0,0,0|3,0,0]=4 9 B11R1.86 CC(=O)Nc1cccnc1F WXVL_AF0419SB0150 [0,0,1,0,0,0|3,0,0]=4 10 B11R1.86 CC(=O)Nc1cccnc1I WXVL_AF0681SB0150 [0,0,1,0,0,0|3,0,0]=4 11 B11R1.86 CC(=O)Nc1cccnc1I WXVL_AF0681SB0150 [0,0,1,0,0,0|3,0,0]=4 12 B11R1.86 CC(=O)Nc1cccnc1O WXVL_AF0440SB0150 [0,0,1,0,0,0|3,0,0]=4 13 B11R1.86 CC(=O)Nc1cccnc1O WXVL_AF0440SB0150 [0,0,1,0,0,0|3,0,0]=4 14 B11R1.91 C=C(C)CNc1ccncn1 WXVL_AK0761LP3358 [0,0,1,0,0,0|2,0,1]=4 15 B11R1.91 C=C(C)CNc1ccncn1 WXVL_AK0761LP3358 [0,0,1,0,0,0|2,0,1]=4 16 B11R1.91 C=C(C)CNc1ncccn1 WXVL_AK0761LP0002 [0,0,1,0,0,0|2,0,1]=4 17 B11R1.91 C=C(C)CNc1ncccn1 WXVL_AK0761LP0002 [0,0,1,0,0,0|2,0,1]=4 18 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [0,0,1,0,0,0|2,0,1]=4 19 B11R1.91 CC(=O)NCc1ccccn1 WXVL_AK0018SB0150 [0,0,1,0,0,0|2,0,1]=4 20 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [0,0,1,0,0,0|3,0,0]=4 21 B11R1.91 NC(=O)/C=C/c1ccccc1 WXVL_AK0084SB0115 [0,0,1,0,0,0|3,0,0]=4 22 B11R1.91 NC(=O)/C=C/c1cnccn1 WXVL_AK0084SA2885 [0,0,1,0,0,0|3,0,0]=4 23 B11R1.91 NC(=O)/C=C/c1cnccn1 WXVL_AK0084SA2885 [0,0,1,0,0,0|3,0,0]=4 24 B12R1.21 Cc1ccc(cc1)C=CC(=O)N WXVL_AK0084SB0060 [0,1,1,0,0,0|2,0,0]=4 25 B12R1.21 Cc1ccc(cc1)C=CC(=O)N WXVL_AK0084SB0060 [0,1,1,0,0,0|2,0,0]=4 26 B12R1.226 NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0084SB1601 [0,1,1,0,0,0|1,0,1]=4 27 B12R1.226 NC(=O)C=Cc1cccc(c1)Cl WXVL_AK0084SB1601 [0,1,1,0,0,0|1,0,1]=4 28 B12R1.226 NC(=O)C=Cc1cccc(c1)O WXVL_AK0084SB0417 [0,1,1,0,0,0|1,0,1]=4 29 B12R1.226 NC(=O)C=Cc1cccc(c1)O WXVL_AK0084SB0417 [0,1,1,0,0,0|1,0,1]=4 30 B12R1.43 C/C(=C\c1cccnc1)/C(=O)N WXVL_AK0084SA1933 [0,1,1,0,0,0|1,0,0]=3 31 B12R1.43 C/C(=C\c1cccnc1)/C(=O)N WXVL_AK0084SA1933 [0,1,1,0,0,0|1,0,0]=3 32 B12R1.75 C=Cc1ccccc1NC(=O)C WXVL_AG2145SB0150 [0,1,1,0,0,0|2,0,0]=4 33 B12R1.75 C=Cc1ccccc1NC(=O)C WXVL_AG2145SB0150 [0,1,1,0,0,0|2,0,0]=4 34 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,1,1,0,0,0|2,0,0]=4 35 B12R1.27 CNC(=O)/C=C/c1ccccc1 WXVL_AK00442SB0115 [0,1,1,0,0,0|2,0,0]=4 36 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,1,1,0,0,0|2,0,0]=4 37 B12R1.27 CNC(=O)/C=C/c1cnccn1 WXVL_AK00442SA2885 [0,1,1,0,0,0|2,0,0]=4 38 B12R2.44 CNc1ccn2nccc2n1 WXVL_AK00442LP3345 [0,1,0,0,1,0|2,0,0]=4 39 B12R2.44 CNc1ccn2nccc2n1 WXVL_AK00442LP3345 [0,1,0,0,1,0|2,0,0]=4 40 B14R2.781 NC(=O)c1ccc2ccccc2c1 WXVL_AK0084SE0013 [0,2,0,0,0,0|1,0,1]=4 41 B14R2.781 NC(=O)c1ccc2ccccc2c1 WXVL_AK0084SE0013 [0,2,0,0,0,0|1,0,1]=4 42 B14R2.781 NC(=O)c1ccc2ncccc2c1 WXVL_AK0084SE0022 [0,2,0,0,0,0|0,0,1]=3 43 B14R2.781 NC(=O)c1ccc2ncccc2c1 WXVL_AK0084SE0022 [0,2,0,0,0,0|0,0,1]=3 44 B14R2.781 NC(=O)c1ccc2nccnc2c1 WXVL_AK0084SE0150 [0,2,0,0,0,0|1,0,1]=4 45 B14R2.781 NC(=O)c1ccc2nccnc2c1 WXVL_AK0084SE0150 [0,2,0,0,0,0|1,0,1]=4 46 B14R2.781 NC(=O)c1ccc2ncncc2c1 WXVL_AK0084SE0470 [0,2,0,0,0,0|1,0,1]=4 47 B14R2.781 NC(=O)c1ccc2ncncc2c1 WXVL_AK0084SE0470 [0,2,0,0,0,0|1,0,1]=4 48 B14R2.2332 CNc1ncc2cc(ccc2n1)Br WXVL_AK00442LQ2208 [0,2,0,0,0,0|2,0,0]=4 49 B14R2.2332 CNc1ncc2cc(ccc2n1)Br WXVL_AK00442LQ2208 [0,2,0,0,0,0|2,0,0]=4 50 B14R2.11684 CNc1ncnc2c1cc(cc2)Br WXVL_AK00442LQ2091 [0,2,0,0,0,0|2,0,0]=4 51 B14R2.11684 CNc1ncnc2c1cc(cc2)Br WXVL_AK00442LQ2091 [0,2,0,0,0,0|2,0,0]=4 52 B14R2.11684 CNc1ncnc2c1cc(cc2)C WXVL_AK00442LP0622 [0,2,0,0,0,0|1,0,0]=3 53 B14R2.11684 CNc1ncnc2c1cc(cc2)C WXVL_AK00442LP0622 [0,2,0,0,0,0|1,0,0]=3 54 B14R2.11684 CNc1ncnc2c1cc(cc2)F WXVL_AK00442LP0380 [0,2,0,0,0,0|2,0,0]=4 55 B14R2.11684 CNc1ncnc2c1cc(cc2)F WXVL_AK00442LP0380 [0,2,0,0,0,0|2,0,0]=4 56 B14R2.11684 CNc1ncnc2c1cc(cc2)I WXVL_AK00442LP3352 [0,2,0,0,0,0|2,0,0]=4 57 B14R2.11684 CNc1ncnc2c1cc(cc2)I WXVL_AK00442LP3352 [0,2,0,0,0,0|2,0,0]=4