53313052 -OEChem-05072406522D 68 71 0 1 0 0 0 0 0999 V2000 2.8410 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 11.0299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 8.0299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6155 9.9953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5923 7.9955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 11.0299 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 13.0299 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5331 11.5091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 13.0646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4410 6.4856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7437 9.5054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4756 9.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7322 8.5054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4641 8.4854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 10.9953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 11.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 12.5299 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7331 12.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 11.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5808 6.9955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 10.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 13.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 9.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5331 12.5507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 6.5056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6975 5.5056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4294 5.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5576 4.9957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 8.0299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 9.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 8.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2070 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5384 10.0904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1319 9.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0849 9.3706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6944 10.0655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1229 8.6202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5134 7.9253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6694 7.9004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0759 8.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 13.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 13.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0791 9.4473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4776 10.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 13.5669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 13.3399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 12.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0688 12.8628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1757 6.8218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 8.2199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 10.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 5.2019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9627 5.1694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5505 4.3757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 7.4099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 9.8399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 9.0669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.8399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 7.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 39 1 0 0 0 0 2 39 1 0 0 0 0 3 39 1 0 0 0 0 4 23 2 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 40 1 0 0 0 0 6 68 1 0 0 0 0 7 40 2 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 8 19 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 9 24 1 0 0 0 0 10 20 1 0 0 0 0 10 23 1 0 0 0 0 10 25 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 11 50 1 0 0 0 0 12 19 2 0 0 0 0 12 28 1 0 0 0 0 13 22 1 0 0 0 0 13 28 2 0 0 0 0 14 24 1 0 0 0 0 14 33 2 0 0 0 0 15 17 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 21 49 1 0 0 0 0 24 29 2 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 28 56 1 0 0 0 0 29 32 1 0 0 0 0 29 57 1 0 0 0 0 30 35 1 0 0 0 0 30 58 1 0 0 0 0 31 36 2 0 0 0 0 31 59 1 0 0 0 0 32 34 2 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 35 37 2 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 38 65 1 0 0 0 0 38 66 1 0 0 0 0 38 67 1 0 0 0 0 39 40 1 0 0 0 0 M END > 53313052 > 1 > 734 > 13 > 2 > 5 > AAADceB7uYAAAAAAAAAAAAAAAAAAAAAAAAA8WLFiAAAAAACx8AAAHwAQCAAADCzBmhY//pfIFgCoAjf3fACCiCkxMqAJ2KG+fJiMbuLE+fuUNChs1hPI6CeQ0AIOIAAAAAAAAABAAAAAAAAAAAAAAAAAAA== > 5-[(4-methoxyphenyl)methyl]-7-methyl-4-[4-(2-pyridyl)piperazin-1-yl]-7,8-dihydropteridin-6-one;2,2,2-trifluoroacetic acid > 5-[(4-methoxyphenyl)methyl]-7-methyl-4-[4-(2-pyridinyl)-1-piperazinyl]-7,8-dihydropteridin-6-one;2,2,2-trifluoroacetic acid > 5-[(4-methoxyphenyl)methyl]-7-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydropteridin-6-one;2,2,2-trifluoroacetic acid > 5-[(4-methoxyphenyl)methyl]-7-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydropteridin-6-one;2,2,2-trifluoroacetic acid > 5-[(4-methoxyphenyl)methyl]-7-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)-7,8-dihydropteridin-6-one;2,2,2-tris(fluoranyl)ethanoic acid > 7-methyl-5-p-anisyl-4-[4-(2-pyridyl)piperazino]-7,8-dihydropteridin-6-one;2,2,2-trifluoroacetic acid > InChI=1S/C24H27N7O2.C2HF3O2/c1-17-24(32)31(15-18-6-8-19(33-2)9-7-18)21-22(28-17)26-16-27-23(21)30-13-11-29(12-14-30)20-5-3-4-10-25-20;3-2(4,5)1(6)7/h3-10,16-17H,11-15H2,1-2H3,(H,26,27,28);(H,6,7) > ASIVHUXLDQVQCA-UHFFFAOYSA-N > 559.21548689 > C26H28F3N7O4 > 559.5 > CC1C(=O)N(C2=C(N1)N=CN=C2N3CCN(CC3)C4=CC=CC=N4)CC5=CC=C(C=C5)OC.C(=O)(C(F)(F)F)O > CC1C(=O)N(C2=C(N1)N=CN=C2N3CCN(CC3)C4=CC=CC=N4)CC5=CC=C(C=C5)OC.C(=O)(C(F)(F)F)O > 124 > 559.21548689 > 0 > 40 > 0 > 1 > 0 > 0 > 0 > 2 > -1 > 1 5 255 > 12 19 8 12 28 8 13 22 8 13 28 8 14 24 8 14 33 8 19 20 8 20 22 8 21 26 3 24 29 8 27 30 8 27 31 8 29 32 8 30 35 8 31 36 8 32 34 8 33 34 8 35 37 8 36 37 8 $$$$