TPX-0005

Chemical Properties

Density	1.46±0.1 g/cm3(Predicted)
storage temp.	Store at -20°C
solubility	DMSO:35.0(Max Conc. mg/mL);98.5(Max Conc. mM) Ethanol:10.0(Max Conc. mg/mL);28.1(Max Conc. mM)
form	A crystalline solid
pka	10.79±0.60(Predicted)
InChI	InChI=1S/C18H18FN5O2/c1-10-8-20-18(25)14-9-21-24-6-5-16(23-17(14)24)22-11(2)13-7-12(19)3-4-15(13)26-10/h3-7,9-11H,8H2,1-2H3,(H,20,25)(H,22,23)/t10-,11+/m0/s1
InChIKey	FIKPXCOQUIZNHB-WDEREUQCSA-N
SMILES	O1C2=CC=C(F)C=C2[C@@H](C)NC2C=CN3C(N=2)=C(C=N3)C(=O)NC[C@@H]1C