"ALOGPS" . "-3.1" . "17.11" . "50.6" . "InChIKey=DWAFYCQODLXJNR-BNTLRKBRSA-L" . "7" . "357.409" . "107.17" . "ChemAxon" . "-3.6" . "10" . "1" . "-1" . "0" . "InChI=1S/C17H16N8/c1-2-10(1)13-8-16(25-24-13)22-15-5-6-18-17(23-15)21-11-3-4-12-14(7-11)20-9-19-12/h3-10H,1-2H2,(H,19,20)(H3,18,21,22,23,24,25)" . "-5.4" .