"4.78" . "1" . "291.066221026" . "ALOGPS" . "18.54" . "229.251" . "693.278996673" . "82.81" . "0" . "1.85e-01 g/l" . "-3" . "1.17e+00 g/l" . "InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)" . "2.07" . "2" . "ChemAxon" . "1.58e-02 g/l" . "InChIKey=WSMBXSQDFPTODV-BXKVDMCESA-N" . "HANSCH,C ET AL. (1995)" .