-ISIS- 08251614502D 25 27 0 0 0 0 0 0 0 0999 V2000 -1.7625 -0.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6375 0.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8583 -0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6833 -0.7917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 -3.3583 0.8042 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 -3.4750 -0.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4375 1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6583 0.7792 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.8208 -0.2167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4042 -0.5792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3125 2.1875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2083 -1.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8083 -1.7792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 1.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1958 -1.2625 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8042 -0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2333 1.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5833 -2.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7917 -0.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4167 0.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7625 1.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 0.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0167 1.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0042 1.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 1 1 0 0 0 0 4 1 1 0 0 0 0 5 6 1 0 0 0 0 6 4 1 0 0 0 0 7 2 1 0 0 0 0 8 3 2 0 0 0 0 9 2 1 0 0 0 0 10 8 1 0 0 0 0 11 6 2 0 0 0 0 12 7 2 0 0 0 0 13 10 1 0 0 0 0 14 4 1 0 0 0 0 15 5 1 0 0 0 0 16 13 1 0 0 0 0 17 16 1 0 0 0 0 18 9 1 0 0 0 0 19 16 1 0 0 0 0 20 17 2 0 0 0 0 21 17 1 0 0 0 0 22 18 1 0 0 0 0 23 20 1 0 0 0 0 24 21 2 0 0 0 0 25 24 1 0 0 0 0 9 8 1 0 0 0 0 7 5 1 0 0 0 0 25 23 2 0 0 0 0 M END > (STK771228) STK771228 > (STK771228) 4 > (STK771228) 1.872 > (STK771228) 90.7 > (STK771228) 2 > (STK771228) 3 > (STK771228) 3 > (STK771228) 7-ethyl-8-[(2-hydroxy-2-phenylethyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione > (STK771228) 343.39 > (STK771228) C17H21N5O3 > (STK771228) CCn1c(NCC(c2ccccc2)O)nc2c1c(=O)n(c(=O)n2C)C $$$$