"ALOGPS" . "5.53" . "5.89e-03 g/l" . "90.15" . "myxothiazol" . "3" . "52.86" . "2" . "ChemAxon" . "32.12" . "3.26" . "0" . "InChI=1S/C11H16BrNO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3" . "-4.1" . "1" . "4.19e-03 g/l" . "CC(C)CN1C=NC2=C1C1=CC=CC=C1N=C2N" . "InChIKey=DZEJHPMTDNDECN-UHFFFAOYSA-N" .