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ML167

ML167 structure

CAS No:
1285702-20-6
Formula:
C19H17N3O3
Chemical Name:
ML167
Synonyms:
ML167;ML167/ML-167;5-[4-[[(5-Methyl-2-furanyl)methyl]amino]-6-quinazolinyl]-2-furanmethanol;CID 44968231;5-[4-[[(5-Methyl-2-furanyl)methyl]amino]-6-quinazolinyl]-2-furanmethanol ML167;NCGC00188654;(5-(4-(((5-Methylfuran-2-yl)methyl)amino)quinazolin-6-yl)furan-2-yl)methanol
Categories:
Biochemical Engineering > Inhibitors

Description

ML167 is a highly selective Cdc2-like kinase 4 (Clk4) inhibitor with IC50 of 136 nM, >10-fold selectivity for closely related kinases Clk1, Clk2, Clk3 and Dyrk1A/1B.

[5-[4-[(5-methyl-2-furanyl)methylamino]-6-quinazolinyl]-2-furanyl]methanol is a member of quinazolines.

ML167 Basic Attributes

Molecular Weight：

335.35658

Exact Mass：

335.126984

EC Number：

-0

Characteristics

PSA：

75.53000

XLogP3：

2.68

Appearance：

off-white to gray to brown

Density：

1.3±0.1 g/cm3

Boiling Point：

531.8±45.0 °C at 760 mmHg

Flash Point：

275.4±28.7 °C

Refractive Index：

1.679

Water Solubility：

DMSO: soluble10mg/mL, clear

Storage Conditions：

-20°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

safety instructions：

Marks：

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

Computed Properties

Molecular Weight:335.4
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:335.12699141
Monoisotopic Mass:335.12699141
Topological Polar Surface Area:84.3
Heavy Atom Count:25
Complexity:438
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes