Molecule

2-(4-Hydroxyphenyl)-3h-Quinazolin-4-One

AlkaPlorer ID: AK007563

Synonym: None

IUPAC Name: 2-(4-hydroxyphenyl)-3H-quinazolin-4-one

Structure

SMILES: C1=CC=C2C(=C1)C(=O)NC(=N2)C3=CC=C(C=C3)O

InChI: InChI=1S/C14H10N2O2/c17-10-7-5-9(6-8-10)13-15-12-4-2-1-3-11(12)14(18)16-13/h1-8,17H,(H,15,16,18)

InChIKey: HMZVOPJPTNTGGO-UHFFFAOYSA-N

Reference

Quinazoline Alkaloids from Streptomyces michiganensis

PubChem CID: 135405744

CAS: 89860-51-5

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Streptomyces xanthochromogenes	Streptomyces	Streptomycetaceae	Kitasatosporales	Actinomycetes	Actinomycetota	Bacillati	Bacteria

Properties Information

Molecule Weight: 238.246

TPSA？: 65.98

MolLogP？: 2.2956999999999996

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Escherichia coli	Escherichia coli	MIC	128.0	ug.mL-1	10.1016/j.bmcl.2017.05.064
Homo sapiens	Beta-glucuronidase	IC50	22200.0	nM	10.1016/j.bmc.2014.04.039
Homo sapiens	Beta-glucuronidase	IC50	22200.0	nM	10.1016/j.ejmech.2019.111921
Homo sapiens	Cyclin-dependent kinase 4/cyclin D1	Inhibition	30.0	%	10.1016/j.ejmech.2019.01.011
Homo sapiens	Cytochrome P450 1A1	Inhibition	36.6	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 1A1	Inhibition	42.8	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 1A1	Inhibition	77.6	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 1A2	Inhibition	12.8	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 1B1	Inhibition	0.2	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 1B1	Inhibition	47.3	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 1B1	Inhibition	59.8	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 2C19	Inhibition	0.0	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 2C9	Inhibition	0.0	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 2D6	Inhibition	7.9	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	Cytochrome P450 3A4	Inhibition	0.5	%	10.1016/j.ejmech.2017.02.032
Homo sapiens	HT-29	Activity	nan	None	10.1016/j.ejmech.2016.04.041
Homo sapiens	HT-29	Inhibition	12.0	%	10.1016/j.ejmech.2016.04.041
Homo sapiens	HT-29	Inhibition	13.0	%	10.1016/j.ejmech.2016.04.041
Homo sapiens	HT-29	Inhibition	60.0	%	10.1016/j.ejmech.2016.04.041
Homo sapiens	PC-3	IC50	30000.0	nM	10.1016/j.bmc.2014.04.039
Homo sapiens	Poly [ADP-ribose] polymerase-1	IC50	6429.0	nM	10.1016/j.ejmech.2016.04.041
Homo sapiens	Tankyrase-1	IC50	528.0	nM	10.1016/j.ejmech.2016.04.041
Homo sapiens	Tankyrase-2	IC50	189.0	nM	10.1016/j.ejmech.2016.04.041
Homo sapiens	Tankyrase-2	Inhibition	12.0	%	10.1016/j.ejmech.2016.04.041
Homo sapiens	Tankyrase-2	Inhibition	42.0	%	10.1016/j.ejmech.2016.04.041
Homo sapiens	Tankyrase-2	Inhibition	68.0	%	10.1016/j.ejmech.2016.04.041
Staphylococcus aureus	Staphylococcus aureus	MIC	128.0	ug.mL-1	10.1016/j.bmcl.2017.05.064
None	Unchecked	Activity	91.0	%	10.1016/j.bmcl.2017.05.064
None	Unchecked	IC50	10500.0	nM	10.1016/j.bmc.2015.10.038